Chemical ID: 4184814

Cc1ccc(cc1NC(=O)c2cccs2)NC(=O)c3cccs3
Chemical ID:
4184814
Name [?]:
N-[2-methyl-5-(2-thienylcarbonylamino)phenyl]thiophene-2-carboxamide
SMILES [?]:
Cc1ccc(cc1NC(=O)c2cccs2)NC(=O)c3cccs3
InChi [?]:
InChI=1/C17H14N2O2S2/c1-11-6-7-12(18-16(20)14-4-2-8-22-14)10-13(11)19-17(21)15-5-3-9-23-15/h2-10H,1H3,(H,18,20)(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,21,13,20,12,3,4,22,14,6,2,5,7,19,11,17,9,16,8,18,10,23,15/rA:23nCCCCCCCNCOCCCCSNCOCCCCS/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;d11;s12;d13;s11s14;s5;s16;d17;s17;d19;s20;d21;s19s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14N2O2S2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.2292
Area:546.173
Solvation:-2.42515
Coulombic:-45.1797
Bond Count [?]
All:25
Single:16
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:342.437
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.24
LogP (Chemaxon):2.81

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Descriptor Annotations

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