N-[(4-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
N-[(4-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0586 |
| Compound Name: | N-[(4-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide |
| Molecular Weight: | 436.56 |
| Molecular Formula: | C28 H28 N4 O |
| Smiles: | Cc1ccc(CNC(c2ccc3ccnc(c3c2)N2CCN(CC2)c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3532 |
| logD: | 5.3397 |
| logSw: | -5.6145 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.074 |
| InChI Key: | YVPGZTIKZYKMTJ-UHFFFAOYSA-N |