methyl N-(2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carbonyl)-L-valinate
Chemical Structure Depiction of
methyl N-(2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carbonyl)-L-valinate
methyl N-(2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carbonyl)-L-valinate
Compound characteristics
| Compound ID: | Y044-5338 |
| Compound Name: | methyl N-(2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carbonyl)-L-valinate |
| Molecular Weight: | 316.35 |
| Molecular Formula: | C17 H20 N2 O4 |
| Smiles: | CC(C)[C@@H](C(=O)OC)NC(C1=CN(C)C(c2ccccc12)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5723 |
| logD: | 1.5723 |
| logSw: | -2.1769 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.398 |
| InChI Key: | YKJOTPNQKCAITF-AWEZNQCLSA-N |