3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C096-1298 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C29 H31 N3 O4 |
| Smiles: | CN1C(C(C(N2CCN(CC2)c2ccccc2)=O)c2ccccc2C1=O)c1ccc(c(c1)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2475 |
| logD: | 3.2475 |
| logSw: | -3.5629 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.858 |
| InChI Key: | LBBDLQFETCUETO-UHFFFAOYSA-N |