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132932-26-4

132932-26-4 | 6H-Pyrido[2,3-b][1,4]benzodiazepin-6-one, 5,11-diethyl-5,11-dihydro-10-methyl-

CAS No: 132932-26-4 Catalog No: AG0011EJ MDL No:

Product Description

Catalog Number:
AG0011EJ
Chemical Name:
6H-Pyrido[2,3-b][1,4]benzodiazepin-6-one, 5,11-diethyl-5,11-dihydro-10-methyl-
CAS Number:
132932-26-4
Molecular Formula:
C17H19N3O
Molecular Weight:
281.3523
IUPAC Name:
5,11-diethyl-10-methylpyrido[2,3-b][1,4]benzodiazepin-6-one
InChI:
InChI=1S/C17H19N3O/c1-4-19-14-10-7-11-18-16(14)20(5-2)15-12(3)8-6-9-13(15)17(19)21/h6-11H,4-5H2,1-3H3
InChI Key:
IQKVTEOEVNQTDY-UHFFFAOYSA-N
SMILES:
CCn1c2ncccc2n(c(=O)c2c1c(C)ccc2)CC

Properties

Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.153g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.359g/mol
Monoisotopic Mass:
281.153g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

Literature

Title Journal
Novel non-nucleoside inhibitors of HIV-1 reverse transcriptase. 1. Tricyclic pyridobenzo- and dipyridodiazepinones. Journal of medicinal chemistry 19910701

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