N-[(2-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[(2-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
N-[(2-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0720 |
| Compound Name: | N-[(2-methylphenyl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide |
| Molecular Weight: | 436.56 |
| Molecular Formula: | C28 H28 N4 O |
| Smiles: | Cc1ccccc1CNC(c1ccc2ccnc(c2c1)N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8178 |
| logD: | 5.8041 |
| logSw: | -5.712 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.074 |
| InChI Key: | VCCUCSMORYVGAN-UHFFFAOYSA-N |