Chemical ID: 4796645

Cc1cc(nc(n1)NS(=O)(=O)c2ccc(cc2)NC(=O)C(C)(C)C)C
Chemical ID:
4796645
Name [?]:
N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2,2-dimethyl-propanamide
SMILES [?]:
Cc1cc(nc(n1)NS(=O)(=O)c2ccc(cc2)NC(=O)C(C)(C)C)C
InChi [?]:
InChI=1/C17H22N4O3S/c1-11-10-12(2)19-16(18-11)21-25(23,24)14-8-6-13(7-9-14)20-15(22)17(3,4)5/h6-10H,1-5H3,(H,20,22)(H,18,19,21)
InChi Info:
AuxInfo=1/1/N:1,25,22,23,24,14,16,13,17,3,2,4,15,12,19,6,21,7,5,18,8,20,10,11,9/E:(1,2)(3,4,5)(6,7)(8,9)(11,12)(18,19)(23,24)/CRV:25.6/rA:25nCCCCNCNNSOOCCCCCCNCOCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;d9;s9;s12;d13;s14;d15;d12s16;s15;s18;d19;s19;s21;s21;s21;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H22N4O3S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.3859
Area:554.192
Solvation:-3.46886
Coulombic:-43.1638
Bond Count [?]
All:26
Single:17
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:362.448
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.78
LogP (Chemaxon):2.68

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Descriptor Annotations

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