Chemical ID: 7435281

CCNS(=O)(=O)c1ccc(cc1)NC(=O)C(C)C
Chemical ID:
7435281
Name [?]:
N-[4-(ethylsulfamoyl)phenyl]-2-methyl-propanamide
SMILES [?]:
CCNS(=O)(=O)c1ccc(cc1)NC(=O)C(C)C
InChi [?]:
InChI=1/C12H18N2O3S/c1-4-13-18(16,17)11-7-5-10(6-8-11)14-12(15)9(2)3/h5-9,13H,4H2,1-3H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,17,18,2,9,11,8,12,16,10,7,14,3,13,15,5,6,4/E:(2,3)(5,6)(7,8)(16,17)/CRV:18.6/rA:18nCCNSOOCCCCCCNCOCCC/rB:s1;s2;s3;d4;d4;s4;s7;d8;s9;d10;d7s11;s10;s13;d14;s14;s16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H18N2O3S
All Atoms:36
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.80826
Area:463.2
Solvation:-2.77173
Coulombic:-32.0766
Bond Count [?]
All:18
Single:12
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:270.349
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.09
LogP (Chemaxon):1.78

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Descriptor Annotations

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