2-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
2-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0166 |
| Compound Name: | 2-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 493.92 |
| Molecular Formula: | C25 H21 Cl F N5 O3 |
| Smiles: | C1CN(CCN1CC1=Nc2ccc(cc2C(N1c1ccccc1F)=O)[N+]([O-])=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.747 |
| logD: | 3.747 |
| logSw: | -4.2339 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.939 |
| InChI Key: | NJBGBUZGQXBOQK-UHFFFAOYSA-N |