2-{[(3,4-diethoxyphenyl)methyl]amino}-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3,4-diethoxyphenyl)methyl]amino}-6-methylpyrimidin-4(3H)-one
2-{[(3,4-diethoxyphenyl)methyl]amino}-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | P197-0003 |
| Compound Name: | 2-{[(3,4-diethoxyphenyl)methyl]amino}-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 303.36 |
| Molecular Formula: | C16 H21 N3 O3 |
| Smiles: | CCOc1ccc(CNC2NC(C=C(C)N=2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 1.1461 |
| logD: | 1.1325 |
| logSw: | -2.1225 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.099 |
| InChI Key: | DMPPAYHSXWDSRM-UHFFFAOYSA-N |