4-(4-chlorophenyl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-chlorophenyl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]piperazine-1-carboxamide
4-(4-chlorophenyl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6588 |
| Compound Name: | 4-(4-chlorophenyl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]piperazine-1-carboxamide |
| Molecular Weight: | 412.92 |
| Molecular Formula: | C22 H25 Cl N4 O2 |
| Smiles: | C1CN(Cc2ccccc12)C(CNC(N1CCN(CC1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3187 |
| logD: | 3.318 |
| logSw: | -3.6761 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.344 |
| InChI Key: | NCMDZYSSNWMABZ-UHFFFAOYSA-N |