6-bromo-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2H-1-benzopyran-3-carboxamide
6-bromo-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-1258 |
| Compound Name: | 6-bromo-N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 490.83 |
| Molecular Formula: | C23 H25 Br Cl N3 O2 |
| Smiles: | C(CNC(C1COc2ccc(cc2C=1)[Br])=O)CN1CCN(CC1)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4654 |
| logD: | 3.9215 |
| logSw: | -4.4781 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.106 |
| InChI Key: | VMQSBHSHWTWYCW-UHFFFAOYSA-N |