N-methyl-N-[(4-methyloxan-4-yl)methyl]isoquinoline-1-carboxamide
Chemical Structure Depiction of
N-methyl-N-[(4-methyloxan-4-yl)methyl]isoquinoline-1-carboxamide
N-methyl-N-[(4-methyloxan-4-yl)methyl]isoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | P970-1087 |
| Compound Name: | N-methyl-N-[(4-methyloxan-4-yl)methyl]isoquinoline-1-carboxamide |
| Molecular Weight: | 298.38 |
| Molecular Formula: | C18 H22 N2 O2 |
| Smiles: | CC1(CCOCC1)CN(C)C(c1c2ccccc2ccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2723 |
| logD: | 2.2723 |
| logSw: | -2.5886 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.036 |
| InChI Key: | WAAXEVPYSRVLBT-UHFFFAOYSA-N |