2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[2-(4-ethoxyphenyl)ethyl]-4-methylpyrimidine-5-carboxamide
Chemical Structure Depiction of
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[2-(4-ethoxyphenyl)ethyl]-4-methylpyrimidine-5-carboxamide
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[2-(4-ethoxyphenyl)ethyl]-4-methylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | G415-4717 |
| Compound Name: | 2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[2-(4-ethoxyphenyl)ethyl]-4-methylpyrimidine-5-carboxamide |
| Molecular Weight: | 434.49 |
| Molecular Formula: | C24 H26 N4 O4 |
| Smiles: | CCOc1ccc(CCNC(c2cnc(NCc3ccc4c(c3)OCO4)nc2C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2755 |
| logD: | 3.2755 |
| logSw: | -3.456 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.771 |
| InChI Key: | QPNNTMBFRJVPES-UHFFFAOYSA-N |