3-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F797-0090 |
| Compound Name: | 3-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 419.44 |
| Molecular Formula: | C22 H21 N5 O4 |
| Smiles: | C(CN1C=Nc2c3ccccc3[nH]c2C1=O)C(N1CCN(CC1)C(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5216 |
| logD: | 0.5216 |
| logSw: | -1.7585 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.702 |
| InChI Key: | KWPCSLVWLDXSEB-UHFFFAOYSA-N |