7-chloro-N-(2-methylphenyl)-5,5-dioxo-N-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-N-(2-methylphenyl)-5,5-dioxo-N-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-N-(2-methylphenyl)-5,5-dioxo-N-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0088 |
| Compound Name: | 7-chloro-N-(2-methylphenyl)-5,5-dioxo-N-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 445.99 |
| Molecular Formula: | C22 H20 Cl N O3 S2 |
| Smiles: | CCCN(C(c1cc2CS(c3cc(ccc3c2s1)[Cl])(=O)=O)=O)c1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 5.8703 |
| logD: | 5.8703 |
| logSw: | -5.7552 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.732 |
| InChI Key: | RCBGSWCUCAKCHH-UHFFFAOYSA-N |