3-(4-ethylphenyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(4-ethylphenyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4(3H)-one
3-(4-ethylphenyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C512-0111 |
| Compound Name: | 3-(4-ethylphenyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4(3H)-one |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C26 H25 N5 O3 |
| Smiles: | CCc1ccc(cc1)N1C(=Nc2ccccc2C1=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5933 |
| logD: | 4.5929 |
| logSw: | -4.4255 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.853 |
| InChI Key: | BYMXCOBBYQKFFE-UHFFFAOYSA-N |