2-(dimethylamino)-4-[1-(isoquinoline-1-carbonyl)pyrrolidin-3-yl]-N-(2-methoxyethyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(dimethylamino)-4-[1-(isoquinoline-1-carbonyl)pyrrolidin-3-yl]-N-(2-methoxyethyl)pyrimidine-5-carboxamide
2-(dimethylamino)-4-[1-(isoquinoline-1-carbonyl)pyrrolidin-3-yl]-N-(2-methoxyethyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | SA01-1089 |
| Compound Name: | 2-(dimethylamino)-4-[1-(isoquinoline-1-carbonyl)pyrrolidin-3-yl]-N-(2-methoxyethyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C24 H28 N6 O3 |
| Smiles: | CN(C)c1ncc(C(NCCOC)=O)c(C2CCN(C2)C(c2c3ccccc3ccn2)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1932 |
| logD: | 2.1932 |
| logSw: | -2.8807 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.925 |
| InChI Key: | XTTYKXWIFOQQKH-QGZVFWFLSA-N |