3-(2-fluorophenyl)-2-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(2-fluorophenyl)-2-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one
3-(2-fluorophenyl)-2-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0196 |
| Compound Name: | 3-(2-fluorophenyl)-2-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 487.53 |
| Molecular Formula: | C27 H26 F N5 O3 |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)CC1=Nc2ccc(cc2C(N1c1ccccc1F)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.043 |
| logD: | 4.0429 |
| logSw: | -4.1845 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.158 |
| InChI Key: | NHZLYFHNXUOTHU-IBGZPJMESA-N |