Chemical ID: 3930092

COc1ccc(cc1)C(=O)Nc2ccc(cn2)NC(=O)c3cccs3
Chemical ID:
3930092
Name [?]:
N-[6-(4-methoxybenzoyl)amino-3-pyridyl]thiophene-2-carboxamide
SMILES [?]:
COc1ccc(cc1)C(=O)Nc2ccc(cn2)NC(=O)c3cccs3
InChi [?]:
InChI=1/C18H15N3O3S/c1-24-14-7-4-12(5-8-14)17(22)21-16-9-6-13(11-19-16)20-18(23)15-3-2-10-25-15/h2-11H,1H3,(H,20,23)(H,19,21,22)
InChi Info:
AuxInfo=1/1/N:1,23,22,5,7,14,4,8,13,24,16,6,15,3,21,12,9,19,17,18,11,10,20,2,25/E:(4,5)(7,8)/rA:25nCOCCCCCCCONCCCCCNNCOCCCCS/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s9;s11;s12;d13;s14;d15;d12s16;s15;s18;d19;s19;d21;s22;d23;s21s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H15N3O3S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.19286
Area:569.194
Solvation:-5.03698
Coulombic:-54.4326
Bond Count [?]
All:27
Single:17
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:353.396
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.96
LogP (Chemaxon):2.71

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