Chemical ID: 5106785

CCNC(=O)CN(c1ccccc1OCC)S(=O)(=O)c2ccccc2
Chemical ID:
5106785
Name [?]:
2-[(2-ethoxyphenyl)-phenylsulfonyl-amino]-N-ethyl-acetamide
SMILES [?]:
CCNC(=O)CN(c1ccccc1OCC)S(=O)(=O)c2ccccc2
InChi [?]:
InChI=1/C18H22N2O4S/c1-3-19-18(21)14-20(16-12-8-9-13-17(16)24-4-2)25(22,23)15-10-6-5-7-11-15/h5-13H,3-4,14H2,1-2H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,16,2,15,23,22,24,10,11,21,25,9,12,6,20,8,13,4,3,7,5,18,19,14,17/E:(6,7)(10,11)(22,23)/CRV:25.6/rA:25cCCNCOCNCCCCCCOCCSOOCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;d9;s10;d11;d8s12;s13;s14;s15;s7;d17;d17;s17;s20;d21;s22;d23;d20s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H22N2O4S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:8.89552
Area:512.545
Solvation:-3.91811
Coulombic:-35.9674
Bond Count [?]
All:26
Single:17
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:362.444
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.21
LogP (Chemaxon):2.21

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Descriptor Annotations

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