N-{2-[2-(2-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{2-[2-(2-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
N-{2-[2-(2-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
Compound ID: | G574-0119 |
Compound Name: | N-{2-[2-(2-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide |
Molecular Weight: | 430.48 |
Molecular Formula: | C23 H18 N4 O3 S |
Smiles: | Cc1ccccc1c1nc2n(c(CCNC(C3=Cc4ccccc4OC3=O)=O)cs2)n1 |
Stereo: | ACHIRAL |
logP: | 3.3664 |
logD: | 3.3664 |
logSw: | -3.8747 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.619 |
InChI Key: | PVROALQYTIIVKJ-UHFFFAOYSA-N |