1-[4-(2-fluorophenyl)piperazin-1-yl]-N-(3-methylbutyl)isoquinoline-7-carboxamide
Chemical Structure Depiction of
1-[4-(2-fluorophenyl)piperazin-1-yl]-N-(3-methylbutyl)isoquinoline-7-carboxamide
1-[4-(2-fluorophenyl)piperazin-1-yl]-N-(3-methylbutyl)isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0455 |
| Compound Name: | 1-[4-(2-fluorophenyl)piperazin-1-yl]-N-(3-methylbutyl)isoquinoline-7-carboxamide |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C25 H29 F N4 O |
| Smiles: | CC(C)CCNC(c1ccc2ccnc(c2c1)N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1348 |
| logD: | 5.1213 |
| logSw: | -5.1556 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.886 |
| InChI Key: | JEJDIXDOECACIE-UHFFFAOYSA-N |