ethyl 4-(6-bromo-8-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(6-bromo-8-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-carboxylate
ethyl 4-(6-bromo-8-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | 8016-0347 |
| Compound Name: | ethyl 4-(6-bromo-8-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-carboxylate |
| Molecular Weight: | 439.26 |
| Molecular Formula: | C18 H19 Br N2 O6 |
| Smiles: | CCOC(N1CCN(CC1)C(C1=Cc2cc(cc(c2OC1=O)OC)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5204 |
| logD: | 2.5204 |
| logSw: | -2.8536 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.903 |
| InChI Key: | QWMHJKGPSTUOSF-UHFFFAOYSA-N |