ethyl 4-{[3-(3-methoxyphenyl)-6-nitro-4-oxo-3,4-dihydroquinazolin-2-yl]methyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[3-(3-methoxyphenyl)-6-nitro-4-oxo-3,4-dihydroquinazolin-2-yl]methyl}piperazine-1-carboxylate
ethyl 4-{[3-(3-methoxyphenyl)-6-nitro-4-oxo-3,4-dihydroquinazolin-2-yl]methyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C284-0073 |
| Compound Name: | ethyl 4-{[3-(3-methoxyphenyl)-6-nitro-4-oxo-3,4-dihydroquinazolin-2-yl]methyl}piperazine-1-carboxylate |
| Molecular Weight: | 467.48 |
| Molecular Formula: | C23 H25 N5 O6 |
| Smiles: | CCOC(N1CCN(CC1)CC1=Nc2ccc(cc2C(N1c1cccc(c1)OC)=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1793 |
| logD: | 2.1792 |
| logSw: | -2.9578 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.304 |
| InChI Key: | NIYBMSWMICOLTC-UHFFFAOYSA-N |