6-bromo-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
6-bromo-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y200-6500 |
| Compound Name: | 6-bromo-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 431.26 |
| Molecular Formula: | C20 H16 Br F N2 O3 |
| Smiles: | C1CN(CCN1C(C1=Cc2cc(ccc2OC1=O)[Br])=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.6132 |
| logD: | 3.6132 |
| logSw: | -3.808 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.069 |
| InChI Key: | INHUIKJPBMGQCQ-UHFFFAOYSA-N |