isoquinolin-6-yl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
isoquinolin-6-yl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
isoquinolin-6-yl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1820 |
| Compound Name: | isoquinolin-6-yl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 426.86 |
| Molecular Formula: | C25 H15 Cl N2 O3 |
| Smiles: | C1=C(C(=O)Oc2ccc3cnccc3c2)c2ccccc2C(N1c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1752 |
| logD: | 4.1637 |
| logSw: | -4.581 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.379 |
| InChI Key: | YZSGNHQFPSTZAT-UHFFFAOYSA-N |