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6152-57-4 | AIDS-089094, 3-Methoxy-4-phenyl-1H-quinolin-2-one
CAS No: 6152-57-4 Catalog No: AG00EKRM MDL No:
Product Description
Catalog Number:
AG00EKRM
Chemical Name:
AIDS-089094, 3-Methoxy-4-phenyl-1H-quinolin-2-one
CAS Number:
6152-57-4
Molecular Formula:
C16H13NO2
Molecular Weight:
251.2799
IUPAC Name:
3-methoxy-4-phenyl-1H-quinolin-2-one
InChI:
InChI=1S/C16H13NO2/c1-19-15-14(11-7-3-2-4-8-11)12-9-5-6-10-13(12)17-16(15)18/h2-10H,1H3,(H,17,18)
InChI Key:
NDTLHHOQSHJIMX-UHFFFAOYSA-N
SMILES:
COc1c(=O)[nH]c2c(c1c1ccccc1)cccc2
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.285g/mol
Monoisotopic Mass:
251.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Isolation and characterization of the fungal metabolite 3-O-methylviridicatin as an inhibitor of tumour necrosis factor alpha-induced human immunodeficiency virus replication. | Antiviral chemistry & chemotherapy 19980301 |
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