N-[(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide
N-[(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | 8019-6223 |
| Compound Name: | N-[(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 539.59 |
| Molecular Formula: | C30 H29 N5 O5 |
| Smiles: | Cc1c(C(NC(c2ccc(c(c2)OC)OC)c2c3cc(c(cc3ccn2)OC)OC)=O)nn(c2ccccc2)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7048 |
| logD: | 3.7021 |
| logSw: | -3.9916 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.481 |
| InChI Key: | UCWQOEKUVVPKJZ-NDEPHWFRSA-N |