methyl N-[4-(methoxycarbonyl)-2-nitrophenyl]isoleucinate
Chemical Structure Depiction of
methyl N-[4-(methoxycarbonyl)-2-nitrophenyl]isoleucinate
methyl N-[4-(methoxycarbonyl)-2-nitrophenyl]isoleucinate
Compound characteristics
| Compound ID: | K783-4445 |
| Compound Name: | methyl N-[4-(methoxycarbonyl)-2-nitrophenyl]isoleucinate |
| Molecular Weight: | 324.33 |
| Molecular Formula: | C15 H20 N2 O6 |
| Smiles: | CCC(C)C(C(=O)OC)Nc1ccc(cc1[N+]([O-])=O)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5054 |
| logD: | 3.5054 |
| logSw: | -3.8527 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.827 |
| InChI Key: | HTVVCRYRDWVUSO-UHFFFAOYSA-N |