N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | C378-0543 |
| Compound Name: | N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 516.04 |
| Molecular Formula: | C30 H30 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1)C1=C(C(NCCCN2CCN(CC2)c2cccc(c2)[Cl])=O)OC(c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8827 |
| logD: | 4.3388 |
| logSw: | -4.8706 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.465 |
| InChI Key: | JBNXQAMGNJCWOG-UHFFFAOYSA-N |