N-[(3-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
N-[(3-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0612 |
| Compound Name: | N-[(3-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide |
| Molecular Weight: | 436.56 |
| Molecular Formula: | C28 H28 N4 O |
| Smiles: | Cc1cccc(CNC(c2ccc3ccnc(c3c2)N2CCN(CC2)c2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.6184 |
| logD: | 5.6048 |
| logSw: | -5.7671 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.074 |
| InChI Key: | UNNCWADKHIPHDY-UHFFFAOYSA-N |