3-(2,4-dimethoxyphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(2,4-dimethoxyphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one
3-(2,4-dimethoxyphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0404 |
| Compound Name: | 3-(2,4-dimethoxyphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 453.5 |
| Molecular Formula: | C23 H27 N5 O5 |
| Smiles: | CCN1CCN(CC1)CC1=Nc2ccc(cc2C(N1c1ccc(cc1OC)OC)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7255 |
| logD: | 1.1485 |
| logSw: | -2.6542 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.39 |
| InChI Key: | BQQPCGDBUWCDQE-UHFFFAOYSA-N |