4-(4-cyclohexylpiperazine-1-carbonyl)-2-(4-methoxyphenyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(4-cyclohexylpiperazine-1-carbonyl)-2-(4-methoxyphenyl)isoquinolin-1(2H)-one
4-(4-cyclohexylpiperazine-1-carbonyl)-2-(4-methoxyphenyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | E456-1516 |
| Compound Name: | 4-(4-cyclohexylpiperazine-1-carbonyl)-2-(4-methoxyphenyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C27 H31 N3 O3 |
| Smiles: | COc1ccc(cc1)N1C=C(C(N2CCN(CC2)C2CCCCC2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.392 |
| logD: | 3.1176 |
| logSw: | -3.765 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.04 |
| InChI Key: | JEYLAWJMPMUSSR-UHFFFAOYSA-N |