5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-3-(2-methylpropyl)furo[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-3-(2-methylpropyl)furo[2,3-d]pyrimidin-4(3H)-one
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-3-(2-methylpropyl)furo[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | E947-0499 |
| Compound Name: | 5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-6-methyl-3-(2-methylpropyl)furo[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C24 H28 N4 O5 |
| Smiles: | CC(C)CN1C=Nc2c(C1=O)c(C(N1CCN(CC1)Cc1ccc3c(c1)OCO3)=O)c(C)o2 |
| Stereo: | ACHIRAL |
| logP: | 2.0717 |
| logD: | 1.8801 |
| logSw: | -2.6934 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.297 |
| InChI Key: | MGCRLNREUYIHRW-UHFFFAOYSA-N |