methyl 4-(4-methyl-2-nitroanilino)-3-(4-methylpiperidin-1-yl)-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-(4-methyl-2-nitroanilino)-3-(4-methylpiperidin-1-yl)-4-oxobutanoate
methyl 4-(4-methyl-2-nitroanilino)-3-(4-methylpiperidin-1-yl)-4-oxobutanoate
Compound characteristics
| Compound ID: | 8015-2642 |
| Compound Name: | methyl 4-(4-methyl-2-nitroanilino)-3-(4-methylpiperidin-1-yl)-4-oxobutanoate |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C18 H25 N3 O5 |
| Smiles: | CC1CCN(CC1)C(CC(=O)OC)C(Nc1ccc(C)cc1[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8839 |
| logD: | 2.8017 |
| logSw: | -3.3819 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.552 |
| InChI Key: | QCFINVNXBNIQLN-INIZCTEOSA-N |