N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | 3909-9032 |
| Compound Name: | N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 531.05 |
| Molecular Formula: | C30 H31 Cl N4 O3 |
| Smiles: | COc1ccc(cc1)N1C=C(C(NCCCN2CCN(CC2)c2cccc(c2)[Cl])=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.6035 |
| logD: | 3.0596 |
| logSw: | -3.8894 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.796 |
| InChI Key: | MUASNSKVTQWRFP-UHFFFAOYSA-N |