N-[(5-methylfuran-2-yl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[(5-methylfuran-2-yl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
N-[(5-methylfuran-2-yl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0654 |
| Compound Name: | N-[(5-methylfuran-2-yl)methyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide |
| Molecular Weight: | 426.52 |
| Molecular Formula: | C26 H26 N4 O2 |
| Smiles: | Cc1ccc(CNC(c2ccc3ccnc(c3c2)N2CCN(CC2)c2ccccc2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.9874 |
| logD: | 4.9737 |
| logSw: | -4.8209 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.337 |
| InChI Key: | NQYQHPRAKSTFNC-UHFFFAOYSA-N |