4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)isoquinolin-1(2H)-one
4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | E456-2193 |
| Compound Name: | 4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 487.99 |
| Molecular Formula: | C28 H26 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(C1=CN(C(c2ccccc12)=O)c1cccc(c1)OC)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8494 |
| logD: | 4.8494 |
| logSw: | -4.8925 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.906 |
| InChI Key: | SCESTCTVMUKDBG-UHFFFAOYSA-N |