2-[(4-benzylpiperazin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(4-benzylpiperazin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
2-[(4-benzylpiperazin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0274 |
| Compound Name: | 2-[(4-benzylpiperazin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 473.51 |
| Molecular Formula: | C26 H24 F N5 O3 |
| Smiles: | C1CN(CCN1CC1=Nc2ccc(cc2C(N1c1ccccc1F)=O)[N+]([O-])=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8445 |
| logD: | 2.7651 |
| logSw: | -3.6475 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.219 |
| InChI Key: | SYKZXJCHIUYCTL-UHFFFAOYSA-N |