Chemical ID: 5838495

Cc1cc(ccc1NC(=O)c2cccs2)N
Chemical ID:
5838495
Name [?]:
N-(4-amino-2-methyl-phenyl)thiophene-2-carboxamide
SMILES [?]:
Cc1cc(ccc1NC(=O)c2cccs2)N
InChi [?]:
InChI=1/C12H12N2OS/c1-8-7-9(13)4-5-10(8)14-12(15)11-3-2-6-16-11/h2-7H,13H2,1H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,13,12,5,6,14,3,2,4,7,11,9,16,8,10,15/rA:16nCCCCCCCNCOCCCCSN/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;d11;s12;d13;s11s14;s4;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H12N2OS
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.57211
Area:411.161
Solvation:-1.70693
Coulombic:-39.1237
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:232.303
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:1.0
LogP (Chemaxon):1.55

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Descriptor Annotations

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