2-methyl-N-(3-methylbutyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-methyl-N-(3-methylbutyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
2-methyl-N-(3-methylbutyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-0353 |
| Compound Name: | 2-methyl-N-(3-methylbutyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 272.34 |
| Molecular Formula: | C16 H20 N2 O2 |
| Smiles: | CC(C)CCNC(C1=CN(C)C(c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5604 |
| logD: | 1.5604 |
| logSw: | -2.3831 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.713 |
| InChI Key: | PTTZCLUTOKXGJK-UHFFFAOYSA-N |