6-bromo-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
6-bromo-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8013-3799 |
| Compound Name: | 6-bromo-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 443.3 |
| Molecular Formula: | C21 H19 Br N2 O4 |
| Smiles: | COc1ccccc1N1CCN(CC1)C(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4633 |
| logD: | 3.4633 |
| logSw: | -3.8083 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.398 |
| InChI Key: | HZGVUFMPDSTKOB-UHFFFAOYSA-N |