methyl 1-(2-methoxy-5-methylanilino)isoquinoline-4-carboxylate
Chemical Structure Depiction of
methyl 1-(2-methoxy-5-methylanilino)isoquinoline-4-carboxylate
methyl 1-(2-methoxy-5-methylanilino)isoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G780-0078 |
| Compound Name: | methyl 1-(2-methoxy-5-methylanilino)isoquinoline-4-carboxylate |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C19 H18 N2 O3 |
| Smiles: | Cc1ccc(c(c1)Nc1c2ccccc2c(cn1)C(=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9883 |
| logD: | 3.9536 |
| logSw: | -4.0252 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.763 |
| InChI Key: | VNAVOSKYUXCQGG-UHFFFAOYSA-N |