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Home > Fluorides > 132687-05-9
132687-05-9 | 5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one, 11-ethyl-6-(fluoromethyl)-6,11-dihydro-
CAS No: 132687-05-9 Catalog No: AG001100 MDL No:
Product Description
Catalog Number:
AG001100
Chemical Name:
5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one, 11-ethyl-6-(fluoromethyl)-6,11-dihydro-
CAS Number:
132687-05-9
Molecular Formula:
C15H14FN3O
Molecular Weight:
271.2896
IUPAC Name:
11-ethyl-6-(fluoromethyl)pyrido[3,2-c][1,5]benzodiazepin-5-one
InChI:
InChI=1S/C15H14FN3O/c1-2-18-12-7-3-4-8-13(12)19(10-16)15(20)11-6-5-9-17-14(11)18/h3-9H,2,10H2,1H3
InChI Key:
VROVGMGODBOTLK-UHFFFAOYSA-N
SMILES:
FCn1c(=O)c2cccnc2n(c2c1cccc2)CC
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.112g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.295g/mol
Monoisotopic Mass:
271.112g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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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