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15000-41-6 | 2(1H)-Quinolinone, 4-hydroxy-3-(phenylmethyl)-
CAS No: 15000-41-6 Catalog No: AG001M7M MDL No:MFCD00100872
Product Description
Catalog Number:
AG001M7M
Chemical Name:
2(1H)-Quinolinone, 4-hydroxy-3-(phenylmethyl)-
CAS Number:
15000-41-6
Molecular Formula:
C16H13NO2
Molecular Weight:
251.2799
MDL Number:
MFCD00100872
IUPAC Name:
3-benzyl-4-hydroxy-1H-quinolin-2-one
InChI:
InChI=1S/C16H13NO2/c18-15-12-8-4-5-9-14(12)17-16(19)13(15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,17,18,19)
InChI Key:
NVGZWGUUHGGGEY-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ccccc2c(c1Cc1ccccc1)O
NSC Number:
675807
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:
2
Isotope Atom Count:
0
Molecular Weight:
251.285g/mol
Monoisotopic Mass:
251.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Design, synthesis and antitubercular potency of 4-hydroxyquinolin-2(1H)-ones. | European journal of medicinal chemistry 20170929 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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