Chemical ID: 7495056

CCOc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)NC(C)C
Chemical ID:
7495056
Name [?]:
4-ethoxy-N-[4-(isopropylsulfamoyl)phenyl]-benzamide
SMILES [?]:
CCOc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)NC(C)C
InChi [?]:
InChI=1/C18H22N2O4S/c1-4-24-16-9-5-14(6-10-16)18(21)19-15-7-11-17(12-8-15)25(22,23)20-13(2)3/h5-13,20H,4H2,1-3H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,24,25,2,6,8,14,18,5,9,15,17,23,7,13,4,16,10,12,22,11,20,21,3,19/E:(2,3)(5,6)(7,8)(9,10)(11,12)(22,23)/CRV:25.6/rA:25nCCOCCCCCCCONCCCCCCSOONCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;d10;s10;s12;s13;d14;s15;d16;d13s17;s16;d19;d19;s19;s22;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H22N2O4S
All Atoms:47
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.3272
Area:576.4
Solvation:-4.0828
Coulombic:-41.1967
Bond Count [?]
All:26
Single:17
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:362.444
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.06
LogP (Chemaxon):2.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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