2-[(4-benzylpiperidin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(4-benzylpiperidin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
2-[(4-benzylpiperidin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0286 |
| Compound Name: | 2-[(4-benzylpiperidin-1-yl)methyl]-3-(2-fluorophenyl)-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 472.52 |
| Molecular Formula: | C27 H25 F N4 O3 |
| Smiles: | C1CN(CCC1Cc1ccccc1)CC1=Nc2ccc(cc2C(N1c1ccccc1F)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5709 |
| logD: | 4.5709 |
| logSw: | -4.5016 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.407 |
| InChI Key: | XCSJNFSYGNUUMH-UHFFFAOYSA-N |