Chemical ID: 6739048

Cc1ccc(cc1)NS(=O)(=O)c2ccc3c(c2)CCN3C(=O)C
Chemical ID:
6739048
Name [?]:
1-acetyl-N-(p-tolyl)indoline-5-sulfonamide
SMILES [?]:
Cc1ccc(cc1)NS(=O)(=O)c2ccc3c(c2)CCN3C(=O)C
InChi [?]:
InChI=1/C17H18N2O3S/c1-12-3-5-15(6-4-12)18-23(21,22)16-7-8-17-14(11-16)9-10-19(17)13(2)20/h3-8,11,18H,9-10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,23,3,7,4,6,13,14,18,19,17,2,21,16,5,12,15,8,20,22,10,11,9/E:(3,4)(5,6)(21,22)/CRV:23.6/rA:23nCCCCCCCNSOOCCCCCCCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;d9;s9;s12;d13;s14;d15;d12s16;s16;s18;s15s19;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18N2O3S
All Atoms:41
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.67157
Area:511.287
Solvation:-3.11059
Coulombic:-26.8937
Bond Count [?]
All:25
Single:16
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:330.402
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.39
LogP (Chemaxon):2.15

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Descriptor Annotations

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