Otenzepad

Base Information

Chemical Name:Otenzepad
CAS No.:102394-31-0
Deprecated CAS:100158-38-1
Molecular Formula:C₂₄H₃₁N₅O₂
Molecular Weight:421.542
Hs Code.:
European Community (EC) Number:692-520-5
NSC Number:664529
UNII:WW6A9TFL2C,OM7J0XAL0S,SX2WTG9R3Z
DSSTox Substance ID:DTXSID0045674
Nikkaji Number:J20.577J
Wikipedia:Otenzepad
Wikidata:Q27088218
NCI Thesaurus Code:C75279
Pharos Ligand ID:6JM9CRCT477Q,6JV7PCNVRYFF
ChEMBL ID:CHEMBL17045
Mol file:102394-31-0.mol

Synonyms:11-((2-((diethylamino)methyl)-1-piperidinyl)acetyl)-5,11-dihydro-6H-pyrido(2,3-b)(1-4)benzodiazepine-6-one;AF-DX 116;AF-DX-116;AFDX 116;otenzepad

Suppliers and Price of Otenzepad

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
AF-DX 116
10mg
$ 100.00

Tocris
AF-DX 116 ≥98%(HPLC)
10
$ 171.00

Tocris
AF-DX 116 ≥98%(HPLC)
50
$ 717.00

Sigma-Aldrich
AF-DX 116 ≥98% (HPLC)
25mg
$ 360.00

Sigma-Aldrich
AF-DX 116 ≥98% (HPLC)
5mg
$ 91.50

Crysdot
11-(2-(2-((Diethylamino)methyl)piperidin-1-yl)acetyl)-5H-benzo[e]pyrido[3,2-b][1,4]diazepin-6(11H)-one 95+%
1g
$ 845.00

Crysdot
11-(2-(2-((Diethylamino)methyl)piperidin-1-yl)acetyl)-5H-benzo[e]pyrido[3,2-b][1,4]diazepin-6(11H)-one 95+%
5g
$ 2230.00

ChemScene
Otenzepad >98.0%
1mg
$ 135.00

ChemScene
Otenzepad >98.0%
5mg
$ 395.00

ApexBio Technology
AF-DX 116
10mg
$ 251.00

Total 15 raw suppliers

Chemical Property of Otenzepad

Chemical Property:

Boiling Point:573.2 °C at 760 mmHg
PKA:11.29±0.20(Predicted)
Flash Point:300.5 °C
PSA：74.23000
Density:1.171 g/cm³
LogP:3.21440
Storage Temp.:Store at RT
Solubility.:DMSO: soluble5mg/mL (clear solution; warmed)
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:421.24777525
Heavy Atom Count:31
Complexity:625

Purity/Quality:

97% ^*data from raw suppliers

AF-DX 116 ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN(CC)CC1CCCCN1CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4
Uses AF-DX 116 has been used as an M2 muscarinic acetylcholine receptor (M2AChR) selective antagonist to study the influence of M2AChR in the regulation of both basal and carbachol-stimulated long-term potentiation at the dentate gyrus (DG-LTP) and pro-nerve growth factor (proNGF) secretion in hippocampal cells of young diabetic rats.

Technology Process of Otenzepad

There total 4 articles about Otenzepad 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: 62.0%

: 28797-48-0
11-(chloroacetyl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one

: 100158-61-0,64168-09-8
D,L-2-[(diethylamino)methyl]piperidine

: 102394-31-0,121029-35-4,122467-13-4,100158-38-1
Otenzepad

Guidance literature:: With sodium carbonate; In acetonitrile; for 5h; Heating;
DOI:10.1021/jm00128a008

Reference yield:

: 1219964-56-3
2-[(diethylamino)methyl]piperidine dihydrochloride

: 28797-48-0
11-(chloroacetyl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one

: 102394-31-0,121029-35-4,122467-13-4,100158-38-1
Otenzepad

Guidance literature:: With sodium carbonate; In propan-1-ol; water; pyrographite; acetonitrile;

Reference yield:

: 885-70-1
5H-benzo[e]pyrido[3,2-b][1,4]diazepin-6(11H)-one

: 102394-31-0,121029-35-4,122467-13-4,100158-38-1
Otenzepad

Guidance literature:: Multi-step reaction with 2 steps

2: 62 percent / sodium carbonate / acetonitrile / 5 h / Heating

With sodium carbonate; In acetonitrile;
DOI:10.1021/jm00128a008