1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]isoquinoline-7-carboxamide
Chemical Structure Depiction of
1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]isoquinoline-7-carboxamide
1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0156 |
| Compound Name: | 1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]isoquinoline-7-carboxamide |
| Molecular Weight: | 487 |
| Molecular Formula: | C28 H27 Cl N4 O2 |
| Smiles: | COc1ccc(CNC(c2ccc3ccnc(c3c2)N2CCN(CC2)c2ccc(cc2)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6285 |
| logD: | 5.615 |
| logSw: | -6.1057 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.618 |
| InChI Key: | NGDQBSHFYSOTMI-UHFFFAOYSA-N |