4-hexyl-N-[2-(3-nitrophenyl)-4-oxoquinazolin-3(4H)-yl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-hexyl-N-[2-(3-nitrophenyl)-4-oxoquinazolin-3(4H)-yl]cyclohexane-1-carboxamide
4-hexyl-N-[2-(3-nitrophenyl)-4-oxoquinazolin-3(4H)-yl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | 3009-4165 |
| Compound Name: | 4-hexyl-N-[2-(3-nitrophenyl)-4-oxoquinazolin-3(4H)-yl]cyclohexane-1-carboxamide |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C27 H32 N4 O4 |
| Smiles: | CCCCCCC1CCC(CC1)C(NN1C(c2cccc(c2)[N+]([O-])=O)=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0709 |
| logD: | 6.0701 |
| logSw: | -5.455 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.325 |
| InChI Key: | JBYMCPNGEAXMAX-UHFFFAOYSA-N |