Chemical ID: 4165386

Cc1ccc2c(c1)c(c(c(=O)[nH]2)c3ccccc3)O
Chemical ID:
4165386
Name [?]:
4-hydroxy-6-methyl-3-phenyl-1H-quinolin-2-one
SMILES [?]:
Cc1ccc2c(c1)c(c(c(=O)[nH]2)c3ccccc3)O
InChi [?]:
InChI=1/C16H13NO2/c1-10-7-8-13-12(9-10)15(18)14(16(19)17-13)11-5-3-2-4-6-11/h2-9H,1H3,(H2,17,18,19)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,14,18,3,4,7,2,13,6,5,9,8,10,12,19,11/E:(3,4)(5,6)/rA:19nCCCCCCCCCCONCCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s9;d10;s5s10;s9;s13;d14;s15;d16;d13s17;s8;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H13NO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.45355
Area:424.289
Solvation:-2.15366
Coulombic:-39.541
Bond Count [?]
All:21
Single:13
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:251.28
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.46
LogP (Chemaxon):3.8

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue