184162-64-9

Basic information

• Product Name: 2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID
• Synonyms: TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID, 2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-;SR 142948;2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID;2-[(5-(2,6-DIMETHOXY-PHENYL)-1-(4-[(3-DIMETHYLAMINO-PROPYL)-METHYL-CARBAMOYL]-2-ISOPROPYL-PHENYL)-1H-PYRAZOLE-3-CARBONYL)-AMINO]-ADAMANTANE-2-CARBOXYLIC ACID;LWULHXVBLMWCHO-UHFFFAOYSA-N
• CAS NO: 184162-64-9
• Molecular Formula: C39H51N5O6
• Molecular Weight: 685.85214
• Mol File: 184162-64-9.mol

Chemical Properties

• Boiling Point: 824.7°C at 760 mmHg
• Flash Point: 452.5°C
• Appearance: /
• Density: 1.29g/cm³
• Vapor Pressure: 8.51E-29mmHg at 25°C
• Refractive Index: 1.636
• Storage Temp.: Store at +4°C
• CAS DataBase Reference: 2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID(184162-64-9)
• EPA Substance Registry System: 2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID(184162-64-9)

Safety Data

• Hazardous Substances Data: 184162-64-9(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID is used as a pharmaceutical compound for its potential therapeutic properties. The compound's structural complexity and functional groups may allow it to interact with various biological targets, making it a candidate for the development of new drugs.
Used in Chemical Research:
In the field of chemical research, 2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID can be used as a starting material or a building block for the synthesis of other complex organic molecules. Its unique structure and functional groups make it an interesting subject for further exploration and modification.
Used in Material Science:
The compound's structural features and functional groups may also find applications in material science, where it could be used to develop new materials with specific properties. For example, its dimethoxyphenyl and dimethylamino groups could potentially be involved in non-covalent interactions, such as hydrogen bonding or π-π stacking, which could be exploited to design materials with tailored properties.
Used in Drug Delivery Systems:
Similar to the use of gallotannin in drug delivery systems, 2-[[[5-(2,6-DIMETHOXYPHENYL)-1-[4-[[[3-(DIMETHYLAMINO)PROPYL]METHYLAMINO]CARBONYL]-2-(1-METHYLETHYL)PHENYL]-1H-PYRAZOL-3-YL]CARBONYL]AMINO]-TRICYCLO[3.3.1.13,7]DECANE-2-CARBOXYLIC ACID could be employed in the development of novel drug delivery systems. Its structural features and functional groups may allow for the design of carriers or vehicles for the targeted delivery of therapeutic agents, potentially improving their bioavailability and therapeutic outcomes.

Biological Activity

Potent non-peptide neurotensin (NT) receptor antagonist that binds with high affinity (IC 50 = 0.32 - 3.96 nM). Attenuates amphetamine-induced hyperactivity and is orally active in vivo .

InChI:InChI=1/C39H51N5O6/c1-23(2)29-21-26(37(46)43(5)15-9-14-42(3)4)12-13-31(29)44-32(35-33(49-6)10-8-11-34(35)50-7)22-30(41-44)36(45)40-39(38(47)48)27-17-24-16-25(19-27)20-28(39)18-24/h8,10-13,21-25,27-28H,9,14-20H2,1-7H3,(H,40,45)(H,47,48)

Upstream product

• 1279881-34-3 1-(4-bromo-2-isopropylphenyl)-5-(2,6-dimethoxyphenyl)-1H-pyrazole-3-carboxylic acid 
• 1476064-46-6 2-({[1-(4-bromo-2-isopropylphenyl)-5-(2,6-dimethoxyphenyl)-1H-pyrazole-3-yl]carbonyl}amino)adamantane-2-carboxylic acid 
• 4543-96-8 N,N,N'-trimethylpropane-1,3-diamine 
• 13939-06-5 molybdenum hexacarbonyl 
• 50294-51-4 2-(amino)tricyclo[3.3.1.13,7]decane-2-carboxylic acid hydrochloride 
• 643-28-7 2-isopropylaniline 
• 81090-34-8 4-bromo-2-isopropyl-aniline 
• 1476068-47-9 methyl 1-(4-bromo-2-isopropylphenyl)-5-(2,6-dimethoxyphenyl)-1H-pyrazole-3-carboxylate 

Downstream Products

• 1613265-66-9 5-(2,6-dimethoxy-phenyl)-1-{4-[(3-dimethylamino-propyl)-methyl-carbamoyl]-2-isopropyl-phenyl}-1H-pyrazole-3-carboxylic acid [2-(2-DOTA(tBu₃)-ammo-ethylcarbamoyl)-adamantan-2-yl]-amide 

Relevant articles and documents

Efficient synthesis of heterocyclic neurotensin receptor ligands by microwave-assisted aminocarbonylation

Marking the heterocyclic neurotensin receptor antagonist SR142948A as a lead compound, the development of an efficient and a practical synthetic route to heterocyclic aryl carboxamides is reported. Thus, a highly efficient and flexible access to these carboxamides was elaborated by taking advantage of microwave-assisted aminocarbonylation reaction mediated by Mo(CO)6, Herrmann's palladacycle, [(t-Bu)3PH]BF4, and DBU.