6-bromo-3-(4-phenylpiperazine-1-carbonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-(4-phenylpiperazine-1-carbonyl)-2H-1-benzopyran-2-one
6-bromo-3-(4-phenylpiperazine-1-carbonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8013-3802 |
| Compound Name: | 6-bromo-3-(4-phenylpiperazine-1-carbonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 413.27 |
| Molecular Formula: | C20 H17 Br N2 O3 |
| Smiles: | C1CN(CCN1C(C1=Cc2cc(ccc2OC1=O)[Br])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4626 |
| logD: | 3.4626 |
| logSw: | -3.7076 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.069 |
| InChI Key: | IUZUFPNFTUEWRI-UHFFFAOYSA-N |