butyl 2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
butyl 2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
butyl 2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | C066-5505 |
| Compound Name: | butyl 2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 259.3 |
| Molecular Formula: | C15 H17 N O3 |
| Smiles: | CCCCOC(C1=CN(C)C(c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1063 |
| logD: | 2.1063 |
| logSw: | -2.774 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.235 |
| InChI Key: | CISNGJYSSWQLIT-UHFFFAOYSA-N |