6-bromo-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
6-bromo-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | Y200-6292 |
| Compound Name: | 6-bromo-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 421.27 |
| Molecular Formula: | C17 H13 Br N2 O4 S |
| Smiles: | Cc1c(C(N)=O)c(NC(C2=Cc3cc(ccc3OC2=O)[Br])=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 2.1329 |
| logD: | -0.7807 |
| logSw: | -2.996 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.104 |
| InChI Key: | YAWYDYRSKBFMJK-UHFFFAOYSA-N |