Chemical ID: 7355472

c1ccc2cc(ccc2c1)NS(=O)(=O)c3ccccc3Br
Chemical ID:
7355472
Name [?]:
2-bromo-N-(2-naphthyl)benzenesulfonamide
SMILES [?]:
c1ccc2cc(ccc2c1)NS(=O)(=O)c3ccccc3Br
InChi [?]:
InChI=1/C16H12BrNO2S/c17-15-7-3-4-8-16(15)21(19,20)18-14-10-9-12-5-1-2-6-13(12)11-14/h1-11,18H
InChi Info:
AuxInfo=1/0/N:1,2,18,17,10,3,19,16,8,7,5,9,4,6,20,15,21,11,13,14,12/E:(19,20)/CRV:21.6/rA:21nCCCCCCCCCCNSOOCCCCCCBr/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;s11;d12;d12;s12;s15;d16;s17;d18;d15s19;s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12BrNO2S
All Atoms:33
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.72392
Area:464.935
Solvation:-1.89945
Coulombic:-14.9141
Bond Count [?]
All:23
Single:13
Double:10
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:362.242
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.78
LogP (Chemaxon):4.4

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Descriptor Annotations

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