N-[(4-chlorophenyl)methyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]isoquinoline-7-carboxamide
N-[(4-chlorophenyl)methyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0749 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]isoquinoline-7-carboxamide |
| Molecular Weight: | 474.95 |
| Molecular Formula: | C26 H23 Cl N4 O3 |
| Smiles: | C(c1ccc(cc1)[Cl])NC(c1ccc2ccnc(c2c1)N1CCN(CC1)C(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0975 |
| logD: | 4.0762 |
| logSw: | -4.4171 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.848 |
| InChI Key: | QBZROGZAOBQHPV-UHFFFAOYSA-N |