N-[(3-chlorophenyl)methyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-[(3-chlorophenyl)methyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C909-0444 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 403.9 |
| Molecular Formula: | C19 H14 Cl N O3 S2 |
| Smiles: | C(c1cccc(c1)[Cl])NC(c1cc2CS(c3ccccc3c2s1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1748 |
| logD: | 4.1748 |
| logSw: | -4.5129 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.845 |
| InChI Key: | ZKZQVBOAYHWHSQ-UHFFFAOYSA-N |