N-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | G777-0210 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 331.82 |
| Molecular Formula: | C17 H14 Cl N O2 S |
| Smiles: | C1CSc2c(cccc2C(NCc2ccccc2[Cl])=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.7765 |
| logD: | 3.7765 |
| logSw: | -4.2382 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.82 |
| InChI Key: | ZZJBOOYWOKDVPM-UHFFFAOYSA-N |