4-[4-cyano-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-(3,4-dichlorophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[4-cyano-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-(3,4-dichlorophenyl)piperazine-1-carboxamide
4-[4-cyano-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-(3,4-dichlorophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | 4576-0151 |
| Compound Name: | 4-[4-cyano-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-(3,4-dichlorophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 496.4 |
| Molecular Formula: | C25 H23 Cl2 N5 O2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(nc2c1ccco1)N1CCN(CC1)C(Nc1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2952 |
| logD: | 6.2947 |
| logSw: | -6.6563 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.571 |
| InChI Key: | LGKSYAXWCXQISG-UHFFFAOYSA-N |