4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[(furan-2-yl)methyl]-N-methylpyrimidine-5-carboxamide
Chemical Structure Depiction of
4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[(furan-2-yl)methyl]-N-methylpyrimidine-5-carboxamide
4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[(furan-2-yl)methyl]-N-methylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V017-8221 |
| Compound Name: | 4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[(furan-2-yl)methyl]-N-methylpyrimidine-5-carboxamide |
| Molecular Weight: | 428.45 |
| Molecular Formula: | C24 H20 N4 O4 |
| Salt: | not_available |
| Smiles: | CN(Cc1ccco1)C(c1cnc(c2ccc3c(c2)OCO3)nc1Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2001 |
| logD: | 3.9252 |
| logSw: | -4.2011 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.627 |
| InChI Key: | JQSPUIDGFZDHDR-UHFFFAOYSA-N |