3-(2-fluorophenyl)-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(2-fluorophenyl)-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one
3-(2-fluorophenyl)-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0100 |
| Compound Name: | 3-(2-fluorophenyl)-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 427.43 |
| Molecular Formula: | C21 H22 F N5 O4 |
| Smiles: | C1CN(CCN1CCO)CC1=Nc2ccc(cc2C(N1c1ccccc1F)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.8879 |
| logD: | 0.7661 |
| logSw: | -2.3621 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.125 |
| InChI Key: | CFFVMIJRLOMVQR-UHFFFAOYSA-N |