3-{[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoic acid
Chemical Structure Depiction of
3-{[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoic acid
3-{[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoic acid
Compound characteristics
| Compound ID: | K783-0811 |
| Compound Name: | 3-{[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoic acid |
| Molecular Weight: | 300.74 |
| Molecular Formula: | C13 H17 Cl N2 O4 |
| Smiles: | CC(C)C(CC(O)=O)NCc1ccc(c(c1)[N+]([O-])=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6033 |
| logD: | 1.6033 |
| logSw: | -2.5711 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.161 |
| InChI Key: | SLYYMYDXCORGAP-NSHDSACASA-N |