Chemical ID: 4714112

CC(=O)c1cccc(c1)NS(=O)(=O)c2ccccc2Cl
Chemical ID:
4714112
Name [?]:
N-(3-acetylphenyl)-2-chloro-benzenesulfonamide
SMILES [?]:
CC(=O)c1cccc(c1)NS(=O)(=O)c2ccccc2Cl
InChi [?]:
InChI=1/C14H12ClNO3S/c1-10(17)11-5-4-6-12(9-11)16-20(18,19)14-8-3-2-7-13(14)15/h2-9,16H,1H3
InChi Info:
AuxInfo=1/0/N:1,17,16,6,5,7,18,15,9,2,4,8,19,14,20,10,3,12,13,11/E:(18,19)/CRV:20.6/rA:20nCCOCCCCCCNSOOCCCCCCCl/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s8;s10;d11;d11;s11;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12ClNO3S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.37706
Area:465.463
Solvation:-3.2595
Coulombic:-20.365
Bond Count [?]
All:21
Single:12
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:309.769
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.18
LogP (Chemaxon):2.43

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