Chemical ID: 3967010

CC1Cc2ccccc2N1NC(=O)c3ccc(c(c3)S(=O)(=O)N)Cl
Chemical ID:
3967010
Name [?]:
4-chloro-N-(2-methylindolin-1-yl)-3-sulfamoyl-benzamide
SMILES [?]:
CC1Cc2ccccc2N1NC(=O)c3ccc(c(c3)S(=O)(=O)N)Cl
InChi [?]:
InChI=1/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)
InChi Info:
AuxInfo=1/1/N:1,6,7,5,8,15,16,3,19,2,4,14,17,9,18,12,24,23,11,10,13,21,22,20/E:(22,23)/CRV:24.6/rA:24cCCCCCCCCCNNCOCCCCCCSOONCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2s9;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;s18;d20;d20;s20;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16ClN3O3S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:2
ZAP Information [?]
Total:9.25631
Area:540.712
Solvation:-4.2615
Coulombic:-37.0717
Bond Count [?]
All:26
Single:17
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:365.835
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:2.16
LogP (Chemaxon):2.24

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