4-tert-butylcyclohexyl 4-(4-nitroanilino)-4-oxobutanoate
Chemical Structure Depiction of
4-tert-butylcyclohexyl 4-(4-nitroanilino)-4-oxobutanoate
4-tert-butylcyclohexyl 4-(4-nitroanilino)-4-oxobutanoate
Compound characteristics
| Compound ID: | 8005-4188 |
| Compound Name: | 4-tert-butylcyclohexyl 4-(4-nitroanilino)-4-oxobutanoate |
| Molecular Weight: | 376.45 |
| Molecular Formula: | C20 H28 N2 O5 |
| Smiles: | CC(C)(C)C1CCC(CC1)OC(CCC(Nc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7609 |
| logD: | 4.7576 |
| logSw: | -4.4806 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.258 |
| InChI Key: | IWCHXGFIGVYVPC-UHFFFAOYSA-N |