5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2,3-dimethyl-7-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2,3-dimethyl-7-nitroquinazolin-4(3H)-one
5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2,3-dimethyl-7-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 8018-7907 |
| Compound Name: | 5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2,3-dimethyl-7-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 398.42 |
| Molecular Formula: | C20 H22 N4 O5 |
| Smiles: | CC1=Nc2cc(cc(c2C(N1C)=O)NCCc1ccc(c(c1)OC)OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.0136 |
| logD: | 2.0136 |
| logSw: | -2.8308 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.443 |
| InChI Key: | VQTUINQOGHDMBD-UHFFFAOYSA-N |