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Home > Pyridines > 132686-80-7
132686-80-7 | 5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one, 6,11-dihydro-11-(2-hydroxyethyl)-6-methyl-
CAS No: 132686-80-7 Catalog No: AG0010ZE MDL No:
Product Description
Catalog Number:
AG0010ZE
Chemical Name:
5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one, 6,11-dihydro-11-(2-hydroxyethyl)-6-methyl-
CAS Number:
132686-80-7
Molecular Formula:
C15H15N3O2
Molecular Weight:
269.2985
IUPAC Name:
11-(2-hydroxyethyl)-6-methylpyrido[3,2-c][1,5]benzodiazepin-5-one
InChI:
InChI=1S/C15H15N3O2/c1-17-12-6-2-3-7-13(12)18(9-10-19)14-11(15(17)20)5-4-8-16-14/h2-8,19H,9-10H2,1H3
InChI Key:
WMKDCDDFJCFMMJ-UHFFFAOYSA-N
SMILES:
OCCn1c2ncccc2c(=O)n(c2c1cccc2)C
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.304g/mol
Monoisotopic Mass:
269.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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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