2-(3,4-dimethylphenyl)-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
2-(3,4-dimethylphenyl)-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | K937-0748 |
| Compound Name: | 2-(3,4-dimethylphenyl)-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one |
| Molecular Weight: | 467.57 |
| Molecular Formula: | C29 H29 N3 O3 |
| Smiles: | Cc1ccc(cc1C)N1C=C(C(N2CCN(CC2)c2ccccc2OC)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.5362 |
| logD: | 4.536 |
| logSw: | -4.4012 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.993 |
| InChI Key: | CHNASKQZJVNMHX-UHFFFAOYSA-N |