N-(4-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(4-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide
N-(4-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
Compound ID: | F186-0811 |
Compound Name: | N-(4-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide |
Molecular Weight: | 409.46 |
Molecular Formula: | C21 H19 N3 O4 S |
Smiles: | CC(c1ccccc1)NC(Cc1csc(NC(c2ccc3c(c2)OCO3)=O)n1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6289 |
logD: | 3.62 |
logSw: | -3.9952 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.35 |
InChI Key: | DJXIUQWUVZIJNK-ZDUSSCGKSA-N |