2-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
2-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0172 |
| Compound Name: | 2-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 487.53 |
| Molecular Formula: | C27 H26 F N5 O3 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)CC1=Nc2ccc(cc2C(N1c1ccccc1F)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.287 |
| logD: | 4.287 |
| logSw: | -4.3262 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.638 |
| InChI Key: | PVEUJFRVJSLHTH-UHFFFAOYSA-N |