Chemical ID: 4076592

c1cc(cc(c1)O)NS(=O)(=O)c2ccc(c(c2)Cl)Cl
Chemical ID:
4076592
Name [?]:
3,4-dichloro-N-(3-hydroxyphenyl)-benzenesulfonamide
SMILES [?]:
c1cc(cc(c1)O)NS(=O)(=O)c2ccc(c(c2)Cl)Cl
InChi [?]:
InChI=1/C12H9Cl2NO3S/c13-11-5-4-10(7-12(11)14)19(17,18)15-8-2-1-3-9(16)6-8/h1-7,15-16H
InChi Info:
AuxInfo=1/0/N:1,2,6,13,14,4,17,3,5,12,15,16,19,18,8,7,10,11,9/E:(17,18)/CRV:19.6/rA:19nCCCCCCONSOOCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;d9;d9;s9;s12;d13;s14;d15;d12s16;s16;s15;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H9Cl2NO3S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.91149
Area:469.444
Solvation:-2.82461
Coulombic:-28.8351
Bond Count [?]
All:20
Single:12
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:318.176
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.55
LogP (Chemaxon):3.36

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