1-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-3-[(pyrimidin-2-yl)amino]propan-1-one
Chemical Structure Depiction of
1-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-3-[(pyrimidin-2-yl)amino]propan-1-one
1-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-3-[(pyrimidin-2-yl)amino]propan-1-one
Compound characteristics
| Compound ID: | IB08-1267 |
| Compound Name: | 1-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-3-[(pyrimidin-2-yl)amino]propan-1-one |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C20 H23 N5 O4 |
| Smiles: | C(CNc1ncccn1)C(N1CCN(CC1)C(C1COc2ccccc2O1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.09 |
| logD: | 0.09 |
| logSw: | -1.54 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 126.63 |
| InChI Key: | AKJCBZSJROIXAB-KRWDZBQOSA-N |