Chemical ID: 7495032

CCOc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCOCC3
Chemical ID:
7495032
Name [?]:
4-ethoxy-N-(4-morpholinosulfonylphenyl)-benzamide
SMILES [?]:
CCOc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCOCC3
InChi [?]:
InChI=1/C19H22N2O5S/c1-2-26-17-7-3-15(4-8-17)19(22)20-16-5-9-18(10-6-16)27(23,24)21-11-13-25-14-12-21/h3-10H,2,11-14H2,1H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,2,6,8,14,18,5,9,15,17,23,27,24,26,7,13,4,16,10,12,22,11,20,21,25,3,19/E:(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(23,24)/CRV:27.6/rA:27nCCOCCCCCCCONCCCCCCSOONCCOCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;d10;s10;s12;s13;d14;s15;d16;d13s17;s16;d19;d19;s19;s22;s23;s24;s25;s22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H22N2O5S
All Atoms:49
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.65579
Area:601.403
Solvation:-5.37929
Coulombic:-44.0718
Bond Count [?]
All:29
Single:20
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:390.454
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.02
LogP (Chemaxon):1.98

Name Annotations

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Descriptor Annotations

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