(4-nitrophenyl)methyl 1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxylate
Chemical Structure Depiction of
(4-nitrophenyl)methyl 1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxylate
(4-nitrophenyl)methyl 1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | 8007-7613 |
| Compound Name: | (4-nitrophenyl)methyl 1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxylate |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C20 H22 N2 O6 S |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)C(=O)OCc1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9107 |
| logD: | 3.9107 |
| logSw: | -3.843 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.189 |
| InChI Key: | NMSHAVNWUQUBMP-UHFFFAOYSA-N |