Chemical ID: 5803642

Cc1c(c(ccc1NC(=O)c2ccc(cc2)Cl)O)C
Chemical ID:
5803642
Name [?]:
4-chloro-N-(4-hydroxy-2,3-dimethyl-phenyl)-benzamide
SMILES [?]:
Cc1c(c(ccc1NC(=O)c2ccc(cc2)Cl)O)C
InChi [?]:
InChI=1/C15H14ClNO2/c1-9-10(2)14(18)8-7-13(9)17-15(19)11-3-5-12(16)6-4-11/h3-8,18H,1-2H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,19,12,16,13,15,6,5,2,3,11,14,7,4,9,17,8,18,10/E:(3,4)(5,6)/rA:19nCCCCCCCNCOCCCCCCClOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s14;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14ClNO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.06281
Area:464.548
Solvation:-2.55089
Coulombic:-38.7233
Bond Count [?]
All:20
Single:13
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:275.73
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.24
LogP (Chemaxon):3.62

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Descriptor Annotations

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