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Home > Pyridines > 132686-94-3
132686-94-3 | 5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one, 6,11-diethyl-6,11-dihydro-
CAS No: 132686-94-3 Catalog No: AG001108 MDL No:
Product Description
Catalog Number:
AG001108
Chemical Name:
5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one, 6,11-diethyl-6,11-dihydro-
CAS Number:
132686-94-3
Molecular Formula:
C16H17N3O
Molecular Weight:
267.3257
IUPAC Name:
6,11-diethylpyrido[3,2-c][1,5]benzodiazepin-5-one
InChI:
InChI=1S/C16H17N3O/c1-3-18-13-9-5-6-10-14(13)19(4-2)16(20)12-8-7-11-17-15(12)18/h5-11H,3-4H2,1-2H3
InChI Key:
TUQHQPVULWJHQZ-UHFFFAOYSA-N
SMILES:
CCn1c(=O)c2cccnc2n(c2c1cccc2)CC
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.137g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.332g/mol
Monoisotopic Mass:
267.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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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