2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[(4-methoxyphenyl)methyl]-4-methylpyrimidine-5-carboxamide
Chemical Structure Depiction of
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[(4-methoxyphenyl)methyl]-4-methylpyrimidine-5-carboxamide
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[(4-methoxyphenyl)methyl]-4-methylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | G415-4591 |
| Compound Name: | 2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[(4-methoxyphenyl)methyl]-4-methylpyrimidine-5-carboxamide |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Smiles: | Cc1c(cnc(NCc2ccc3c(c2)OCO3)n1)C(NCc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9554 |
| logD: | 2.9553 |
| logSw: | -3.3122 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.35 |
| InChI Key: | NEGZLOGVQNWGNC-UHFFFAOYSA-N |