2-{[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]methyl}-5-[(2-chlorophenyl)methoxy]-4H-pyran-4-one
Chemical Structure Depiction of
2-{[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]methyl}-5-[(2-chlorophenyl)methoxy]-4H-pyran-4-one
2-{[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]methyl}-5-[(2-chlorophenyl)methoxy]-4H-pyran-4-one
Compound characteristics
| Compound ID: | V006-7662 |
| Compound Name: | 2-{[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]methyl}-5-[(2-chlorophenyl)methoxy]-4H-pyran-4-one |
| Molecular Weight: | 518.79 |
| Molecular Formula: | C23 H21 Br Cl N3 O4 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCc1ccccc1[Cl])=O)C(c1cc(cnc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7913 |
| logD: | 2.791 |
| logSw: | -3.4068 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.947 |
| InChI Key: | AABHZPONPNBXBK-UHFFFAOYSA-N |