propyl 4-[(1-oxo-1H-2-benzothiopyran-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
propyl 4-[(1-oxo-1H-2-benzothiopyran-3-carbonyl)amino]benzoate
propyl 4-[(1-oxo-1H-2-benzothiopyran-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D443-2488 |
| Compound Name: | propyl 4-[(1-oxo-1H-2-benzothiopyran-3-carbonyl)amino]benzoate |
| Molecular Weight: | 367.42 |
| Molecular Formula: | C20 H17 N O4 S |
| Smiles: | CCCOC(c1ccc(cc1)NC(C1=Cc2ccccc2C(=O)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.72 |
| logD: | 4.7196 |
| logSw: | -4.5703 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.371 |
| InChI Key: | TVKPYAZPAHVMOD-UHFFFAOYSA-N |