[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidine-5-carbonyl)piperazin-1-yl](furan-2-yl)methanone
Chemical Structure Depiction of
[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidine-5-carbonyl)piperazin-1-yl](furan-2-yl)methanone
[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidine-5-carbonyl)piperazin-1-yl](furan-2-yl)methanone
Compound characteristics
| Compound ID: | G415-4648 |
| Compound Name: | [4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-4-methylpyrimidine-5-carbonyl)piperazin-1-yl](furan-2-yl)methanone |
| Molecular Weight: | 449.47 |
| Molecular Formula: | C23 H23 N5 O5 |
| Smiles: | Cc1c(cnc(NCc2ccc3c(c2)OCO3)n1)C(N1CCN(CC1)C(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4399 |
| logD: | 1.4399 |
| logSw: | -2.0368 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.075 |
| InChI Key: | HEQFEYVJJPNFCB-UHFFFAOYSA-N |