Chemical ID: 5374858

Cc1ccc(cc1NC(=O)CS(=O)(=O)c2ccccc2)Cl
Chemical ID:
5374858
Name [?]:
N-(5-chloro-2-methyl-phenyl)-2-phenylsulfonyl-acetamide
SMILES [?]:
Cc1ccc(cc1NC(=O)CS(=O)(=O)c2ccccc2)Cl
InChi [?]:
InChI=1/C15H14ClNO3S/c1-11-7-8-12(16)9-14(11)17-15(18)10-21(19,20)13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,18,17,19,16,20,3,4,6,11,2,5,15,7,9,21,8,10,13,14,12/E:(3,4)(5,6)(19,20)/CRV:21.6/rA:21nCCCCCCCNCOCSOOCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;d12;d12;s12;s15;d16;s17;d18;d15s19;s5;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14ClNO3S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.08304
Area:509.939
Solvation:-4.66543
Coulombic:-23.2533
Bond Count [?]
All:22
Single:13
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:323.795
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.51
LogP (Chemaxon):2.61

Name Annotations

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Descriptor Annotations

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