2-cyclohexyl-3-(4-methoxyphenyl)-4-(4-propylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
2-cyclohexyl-3-(4-methoxyphenyl)-4-(4-propylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
2-cyclohexyl-3-(4-methoxyphenyl)-4-(4-propylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C066-0518 |
| Compound Name: | 2-cyclohexyl-3-(4-methoxyphenyl)-4-(4-propylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 489.66 |
| Molecular Formula: | C30 H39 N3 O3 |
| Smiles: | CCCN1CCN(CC1)C(C1C(c2ccc(cc2)OC)N(C2CCCCC2)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5842 |
| logD: | 4.1643 |
| logSw: | -4.3501 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.855 |
| InChI Key: | SRFRGBIIRYDEIG-UHFFFAOYSA-N |