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Chemical ID: 4175304

Cc1ccccc1NS(=O)(=O)c2cc(ccc2Cl)C(=O)Nc3ccccc3

Chemical ID:

4175304

Name [?]:

4-chloro-3-(o-tolylsulfamoyl)-N-phenyl-benzamide

SMILES [?]:

Cc1ccccc1NS(=O)(=O)c2cc(ccc2Cl)C(=O)Nc3ccccc3

InChi [?]:

InChI=1/C20H17ClN2O3S/c1-14-7-5-6-10-18(14)23-27(25,26)19-13-15(11-12-17(19)21)20(24)22-16-8-3-2-4-9-16/h2-13,23H,1H3,(H,22,24)

InChi Info:

AuxInfo=1/1/N:1,25,24,26,4,5,3,23,27,6,15,16,13,2,14,22,17,7,12,19,18,21,8,20,10,11,9/E:(3,4)(8,9)(25,26)/CRV:27.6/rA:27nCCCCCCCNSOOCCCCCCClCONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;d9;s9;s12;d13;s14;d15;d12s16;s17;s14;d19;s19;s21;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₀H₁₇ClN₂O₃S
All Atoms:	27
Heavy Atoms:	27
Chiral Atoms:	0

ZAP Information [?]

Total:	11.0286
Area:	580.289
Solvation:	-3.47858
Coulombic:	-34.5985

Bond Count [?]

All:	29
Single:	17
Double:	12
Rotors:	6
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	400.879
H-Bond Donors:	2
H-Bond Acceptors:	5
XLogP:	4.53
LogP (Chemaxon):	4.65

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value