N-(4-bromo-2-methylphenyl)-7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-(4-bromo-2-methylphenyl)-7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0248 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 450.8 |
| Molecular Formula: | C19 H13 Br Cl N O S2 |
| Smiles: | Cc1cc(ccc1NC(c1cc2CSc3cc(ccc3c2s1)[Cl])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.5988 |
| logD: | 6.5987 |
| logSw: | -6.1946 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.2992 |
| InChI Key: | BRTSJXOBEJMQOB-UHFFFAOYSA-N |