4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(4-ethoxyphenyl)-2-[2-(morpholin-4-yl)ethyl]-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(4-ethoxyphenyl)-2-[2-(morpholin-4-yl)ethyl]-3,4-dihydroisoquinolin-1(2H)-one
4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(4-ethoxyphenyl)-2-[2-(morpholin-4-yl)ethyl]-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C096-0881 |
| Compound Name: | 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(4-ethoxyphenyl)-2-[2-(morpholin-4-yl)ethyl]-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 603.16 |
| Molecular Formula: | C34 H39 Cl N4 O4 |
| Smiles: | CCOc1ccc(cc1)C1C(C(N2CCN(CC2)c2cccc(c2)[Cl])=O)c2ccccc2C(N1CCN1CCOCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4886 |
| logD: | 4.4861 |
| logSw: | -4.5962 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.553 |
| InChI Key: | HEXOJDXWYMELFF-UHFFFAOYSA-N |