Chemical ID: 4185009

c1cc(cc(c1)NC(=O)c2cccs2)NC(=O)c3cccs3
Chemical ID:
4185009
Name [?]:
N-[3-(2-thienylcarbonylamino)phenyl]thiophene-2-carboxamide
SMILES [?]:
c1cc(cc(c1)NC(=O)c2cccs2)NC(=O)c3cccs3
InChi [?]:
InChI=1/C16H12N2O2S2/c19-15(13-6-2-8-21-13)17-11-4-1-5-12(10-11)18-16(20)14-7-3-9-22-14/h1-10H,(H,17,19)(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,12,20,6,2,11,19,13,21,4,5,3,10,18,8,16,7,15,9,17,14,22/E:(2,3)(4,5)(6,7)(8,9)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)/gE:(1,2)/rA:22nCCCCCCNCOCCCCSNCOCCCCS/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;d10;s11;d12;s10s13;s3;s15;d16;s16;d18;s19;d20;s18s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12N2O2S2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.6543
Area:528.235
Solvation:-2.55158
Coulombic:-45.1562
Bond Count [?]
All:24
Single:15
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:328.411
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.01
LogP (Chemaxon):2.99

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