Chemical ID: 5624673

Cc1cc(ccc1c2csc(n2)NC(=O)c3cccs3)OC
Chemical ID:
5624673
Name [?]:
N-[4-(4-methoxy-2-methyl-phenyl)thiazol-2-yl]thiophene-2-carboxamide
SMILES [?]:
Cc1cc(ccc1c2csc(n2)NC(=O)c3cccs3)OC
InChi [?]:
InChI=1/C16H14N2O2S2/c1-10-8-11(20-2)5-6-12(10)13-9-22-16(17-13)18-15(19)14-4-3-7-21-14/h3-9H,1-2H3,(H,17,18,19)
InChi Info:
AuxInfo=1/1/N:1,22,18,17,5,6,19,3,9,2,4,7,8,16,14,11,12,13,15,21,20,10/rA:22nCCCCCCCCCSCNNCOCCCCSOC/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s9;s10;s8d11;s11;s13;d14;s14;d16;s17;d18;s16s19;s4;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14N2O2S2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.70434
Area:524.438
Solvation:-3.4066
Coulombic:-35.9211
Bond Count [?]
All:24
Single:16
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:330.427
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.21
LogP (Chemaxon):4.08

Name Annotations

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Descriptor Annotations

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