2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-4-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-4-nitrobenzamide
2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3401-5378 |
| Compound Name: | 2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3(4H)-yl)-4-nitrobenzamide |
| Molecular Weight: | 426.86 |
| Molecular Formula: | C21 H19 Cl N4 O4 |
| Smiles: | C1CCC(CC1)C1=Nc2ccccc2C(N1NC(c1ccc(cc1[Cl])[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3602 |
| logD: | 3.3484 |
| logSw: | -4.0313 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.325 |
| InChI Key: | IPTLQSJCHAXKAB-UHFFFAOYSA-N |