2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-3,5-dinitrobenzamide
Chemical Structure Depiction of
2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-3,5-dinitrobenzamide
2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 3401-5377 |
| Compound Name: | 2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-3,5-dinitrobenzamide |
| Molecular Weight: | 471.86 |
| Molecular Formula: | C21 H18 Cl N5 O6 |
| Smiles: | C1CCC(CC1)C1=Nc2ccccc2C(N1NC(c1cc(cc(c1[Cl])[N+]([O-])=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1308 |
| logD: | 2.4788 |
| logSw: | -4.1642 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 118.405 |
| InChI Key: | QFJQRKAFTNNUEA-UHFFFAOYSA-N |