N-[2-(4-chlorophenyl)ethyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-[2-(4-chlorophenyl)ethyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C909-0392 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 417.93 |
| Molecular Formula: | C20 H16 Cl N O3 S2 |
| Smiles: | C(CNC(c1cc2CS(c3ccccc3c2s1)(=O)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0058 |
| logD: | 4.0058 |
| logSw: | -4.6027 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.686 |
| InChI Key: | AKLPBRROAAUCHP-UHFFFAOYSA-N |