methyl 1-{[(4-methoxyphenyl)methyl]amino}isoquinoline-4-carboxylate
Chemical Structure Depiction of
methyl 1-{[(4-methoxyphenyl)methyl]amino}isoquinoline-4-carboxylate
methyl 1-{[(4-methoxyphenyl)methyl]amino}isoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G780-0140 |
| Compound Name: | methyl 1-{[(4-methoxyphenyl)methyl]amino}isoquinoline-4-carboxylate |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C19 H18 N2 O3 |
| Smiles: | COC(c1cnc(c2ccccc12)NCc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3867 |
| logD: | 3.3865 |
| logSw: | -3.4977 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.696 |
| InChI Key: | XARCYIZPTLVKHN-UHFFFAOYSA-N |