3-(2,4-dimethoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(2,4-dimethoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one
3-(2,4-dimethoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0242 |
| Compound Name: | 3-(2,4-dimethoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C22 H25 N5 O5 |
| Smiles: | CN1CCN(CC1)CC1=Nc2ccc(cc2C(N1c1ccc(cc1OC)OC)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.3807 |
| logD: | 0.9112 |
| logSw: | -2.4568 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.33 |
| InChI Key: | VNAMJLKBIYVHRM-UHFFFAOYSA-N |