N-[(3-bromophenyl)methyl]-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide
N-[(3-bromophenyl)methyl]-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide
Compound characteristics
| Compound ID: | E722-1482 |
| Compound Name: | N-[(3-bromophenyl)methyl]-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide |
| Molecular Weight: | 394.35 |
| Molecular Formula: | C17 H16 Br N O S2 |
| Smiles: | Cc1c2CSC(=Cc2sc1C)C(NCc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0658 |
| logD: | 5.0658 |
| logSw: | -4.8009 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.5907 |
| InChI Key: | VDSGURNPRVKYPU-UHFFFAOYSA-N |