N-(4-bromophenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
N-(4-bromophenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
| Compound ID: | D443-2399 |
| Compound Name: | N-(4-bromophenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide |
| Molecular Weight: | 360.23 |
| Molecular Formula: | C16 H10 Br N O2 S |
| Smiles: | C1=C(C(Nc2ccc(cc2)[Br])=O)SC(c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4408 |
| logD: | 4.4402 |
| logSw: | -4.5766 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.323 |
| InChI Key: | JOZGGZLYFBWNIO-UHFFFAOYSA-N |