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Chemical ID: 4753541
Chemical ID:
4753541
Name [?]:
N-(3-sulfamoylphenyl)benzamide
SMILES [?]:
c1ccc(cc1)C(=O)Nc2cccc(c2)S(=O)(=O)N
InChi [?]:
InChI=1/C13H12N2O3S/c14-19(17,18)12-8-4-7-11(9-12)15-13(16)10-5-2-1-3-6-10/h1-9H,(H,15,16)(H2,14,17,18)
InChi Info:
AuxInfo=1/1/N:1,2,6,12,3,5,11,13,15,4,10,14,7,19,9,8,17,18,16/E:(2,3)(5,6)(17,18)/CRV:19.6/rA:19nCCCCCCCONCCCCCCSOON/rB:s1;d2;s3;d4;d1s5;s4;d7;s7;s9;s10;d11;s12;d13;d10s14;s14;d16;d16;s16;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H12N2O3S |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.34234 |
Area: | 452.755 |
Solvation: | -2.97653 |
Coulombic: | -38.491 |
Bond Count [?]
All: | 20 |
Single: | 11 |
Double: | 9 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 276.312 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 5 |
XLogP: | 1.45 |
LogP (Chemaxon): | 1.74 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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