N-(4-chlorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-(4-chlorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C909-0456 |
| Compound Name: | N-(4-chlorophenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 389.88 |
| Molecular Formula: | C18 H12 Cl N O3 S2 |
| Smiles: | C1c2cc(C(Nc3ccc(cc3)[Cl])=O)sc2c2ccccc2S1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.484 |
| logD: | 4.4839 |
| logSw: | -4.7882 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.523 |
| InChI Key: | AYWWYIJYKUNOFZ-UHFFFAOYSA-N |