Chemical ID: 3963582

COc1ccc(cc1)C(=O)Nc2ccc(nc2)NC(=O)c3cccs3
Chemical ID:
3963582
Name [?]:
N-[5-(4-methoxybenzoyl)amino-2-pyridyl]thiophene-2-carboxamide
SMILES [?]:
COc1ccc(cc1)C(=O)Nc2ccc(nc2)NC(=O)c3cccs3
InChi [?]:
InChI=1/C18H15N3O3S/c1-24-14-7-4-12(5-8-14)17(22)20-13-6-9-16(19-11-13)21-18(23)15-3-2-10-25-15/h2-11H,1H3,(H,20,22)(H,19,21,23)
InChi Info:
AuxInfo=1/1/N:1,23,22,5,7,13,4,8,14,24,17,6,12,3,21,15,9,19,16,11,18,10,20,2,25/E:(4,5)(7,8)/rA:25nCOCCCCCCCONCCCCNCNCOCCCCS/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:9.25669
Area:568.851
Solvation:-4.96458
Coulombic:-54.472
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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