Chemical ID: 4076614

CN(C)c1ccc(cc1)NS(=O)(=O)c2ccc(c(c2)OC)OC
Chemical ID:
4076614
Name [?]:
N-(4-dimethylaminophenyl)-3,4-dimethoxy-benzenesulfonamide
SMILES [?]:
CN(C)c1ccc(cc1)NS(=O)(=O)c2ccc(c(c2)OC)OC
InChi [?]:
InChI=1/C16H20N2O4S/c1-18(2)13-7-5-12(6-8-13)17-23(19,20)14-9-10-15(21-3)16(11-14)22-4/h5-11,17H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,3,23,21,6,8,5,9,15,16,19,7,4,14,17,18,10,2,12,13,22,20,11/E:(1,2)(5,6)(7,8)(19,20)/CRV:23.6/rA:23nCNCCCCCCCNSOOCCCCCCOCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;d11;d11;s11;s14;d15;s16;d17;d14s18;s18;s20;s17;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H20N2O4S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.26761
Area:512.97
Solvation:-5.55665
Coulombic:-31.5243
Bond Count [?]
All:24
Single:16
Double:8
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:336.407
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.49
LogP (Chemaxon):2.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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