Chemical ID: 7498413

CCN(CC)S(=O)(=O)c1ccc(cc1)NC(=O)c2ccc(cc2)OC(C)C
Chemical ID:
7498413
Name [?]:
N-[4-(diethylsulfamoyl)phenyl]-4-isopropoxy-benzamide
SMILES [?]:
CCN(CC)S(=O)(=O)c1ccc(cc1)NC(=O)c2ccc(cc2)OC(C)C
InChi [?]:
InChI=1/C20H26N2O4S/c1-5-22(6-2)27(24,25)19-13-9-17(10-14-19)21-20(23)16-7-11-18(12-8-16)26-15(3)4/h7-15H,5-6H2,1-4H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,5,26,27,2,4,19,23,11,13,20,22,10,14,25,18,12,21,9,16,15,3,17,7,8,24,6/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(24,25)/CRV:27.6/rA:27nCCNCCSOOCCCCCCNCOCCCCCCOCCC/rB:s1;s2;s3;s4;s3;d6;d6;s6;s9;d10;s11;d12;d9s13;s12;s15;d16;s16;s18;d19;s20;d21;d18s22;s21;s24;s25;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H26N2O4S
All Atoms:53
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.4088
Area:616.333
Solvation:-3.99956
Coulombic:-36.7958
Bond Count [?]
All:28
Single:19
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:390.498
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.72
LogP (Chemaxon):3.42

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Descriptor Annotations

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