Chemical ID: 4235867

CC(=O)N1CCc2c1ccc(c2)S(=O)(=O)N(C)c3ccccc3
Chemical ID:
4235867
Name [?]:
1-acetyl-N-methyl-N-phenyl-indoline-5-sulfonamide
SMILES [?]:
CC(=O)N1CCc2c1ccc(c2)S(=O)(=O)N(C)c3ccccc3
InChi [?]:
InChI=1/C17H18N2O3S/c1-13(20)19-11-10-14-12-16(8-9-17(14)19)23(21,22)18(2)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,17,21,20,22,19,23,10,9,6,5,12,2,7,18,11,8,16,4,3,14,15,13/E:(4,5)(6,7)(21,22)/CRV:23.6/rA:23cCCONCCCCCCCCSOONCCCCCCC/rB:s1;d2;s2;s4;s5;s6;s4s7;d8;s9;d10;d7s11;s11;d13;d13;s13;s16;s16;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18N2O3S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:9.43206
Area:508.535
Solvation:-3.28133
Coulombic:-22.4096
Bond Count [?]
All:25
Single:16
Double:9
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:330.402
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:2.52
LogP (Chemaxon):1.93

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