2-(4-chlorophenyl)-4-(pyrrolidine-1-carbonyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-4-(pyrrolidine-1-carbonyl)isoquinolin-1(2H)-one
2-(4-chlorophenyl)-4-(pyrrolidine-1-carbonyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | K937-0628 |
| Compound Name: | 2-(4-chlorophenyl)-4-(pyrrolidine-1-carbonyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 352.82 |
| Molecular Formula: | C20 H17 Cl N2 O2 |
| Smiles: | C1CCN(C1)C(C1=CN(C(c2ccccc12)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0599 |
| logD: | 3.0599 |
| logSw: | -3.6955 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.769 |
| InChI Key: | YRXQHCOUYYJNSJ-UHFFFAOYSA-N |