4-oxo-N-(3-phenylpropyl)-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
4-oxo-N-(3-phenylpropyl)-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
4-oxo-N-(3-phenylpropyl)-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | G777-0381 |
| Compound Name: | 4-oxo-N-(3-phenylpropyl)-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 325.43 |
| Molecular Formula: | C19 H19 N O2 S |
| Smiles: | C(Cc1ccccc1)CNC(c1cccc2C(CCSc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9046 |
| logD: | 3.9046 |
| logSw: | -4.1816 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.662 |
| InChI Key: | QWKMXKUWQUTBHR-UHFFFAOYSA-N |