Benzamide, 4-amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)-, (1S-trans)-

Base Information

Chemical Name:Benzamide, 4-amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)-, (1S-trans)-
CAS No.:177187-62-1
Molecular Formula:C₁₈H₂₆ClN₃O₂
Molecular Weight:351.876
Hs Code.:
DSSTox Substance ID:DTXSID90170266
Nikkaji Number:J733.283A
Wikidata:Q76279132
ChEMBL ID:CHEMBL1173123
Mol file:177187-62-1.mol

Synonyms:4-Amino-5-chloro-N-(1-lupinyl)-2-methoxybenzamide;Benzamide, 4-amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)-, (1S-trans)-;177187-62-1;(1S-trans)-4-Amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)benzamide;CHEMBL1173123;DTXSID90170266;LS-25444;N-[[[(9abeta)-Octahydro-4H-quinolizin]-1alpha-yl]methyl]-4-amino-5-chloro-2-methoxybenzamide

Suppliers and Price of Benzamide, 4-amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)-, (1S-trans)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Benzamide, 4-amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)-, (1S-trans)-

Chemical Property:

Vapor Pressure:6.8E-10mmHg at 25°C
Boiling Point:493.8°Cat760mmHg
Flash Point:252.5°C
PSA：71.08000
Density:1.25g/cm³
LogP:4.01900
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:351.1713548
Heavy Atom Count:24
Complexity:437

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=C(C=C1C(=O)NCC2CCCN3C2CCCC3)Cl)N
Isomeric SMILES:COC1=CC(=C(C=C1C(=O)NC[C@@H]2CCCN3[C@@H]2CCCC3)Cl)N

Technology Process of Benzamide, 4-amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)-, (1S-trans)-

There total 8 articles about Benzamide, 4-amino-5-chloro-2-methoxy-N-((octahydro-2H-quinolizin-1-yl)methyl)-, (1S-trans)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 67.2%

: C-(octahydroquinolizin-1-yl)methylamine dihydrochloride

: 7206-70-4
4-amino-5-chloro-2-methoxybenzoic acid

: 177187-62-1
C₁₈H₂₆ClN₃O₂

Guidance literature:: With N-ethyl-N,N-diisopropylamine; HATU; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 24h;

Reference yield: 67.2%

: 177187-62-1
C₁₈H₂₆ClN₃O₂

Guidance literature:: With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 24h;

Reference yield:

: 2346-98-7,10248-19-8,15527-89-6,22342-32-1,46000-58-2,75532-84-2,145842-67-7
aminolupinane

: 177187-62-1
4-Amino-5-chloro-2-methoxy-N-[(1S,9aR)-1-(octahydro-quinolizin-1-yl)methyl]-benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: methanol / 18 h / 110 °C

2: 2 N NaOH / methanol / 5 h / Heating

With sodium hydroxide; In methanol;