3-(2-chloro-5-nitrophenyl)-3-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]propanoic acid
Chemical Structure Depiction of
3-(2-chloro-5-nitrophenyl)-3-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]propanoic acid
3-(2-chloro-5-nitrophenyl)-3-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]propanoic acid
Compound characteristics
| Compound ID: | 8015-5820 |
| Compound Name: | 3-(2-chloro-5-nitrophenyl)-3-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]propanoic acid |
| Molecular Weight: | 406.86 |
| Molecular Formula: | C20 H23 Cl N2 O5 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(NC(CC(O)=O)c1cc(ccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5761 |
| logD: | 1.9383 |
| logSw: | -4.4791 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.081 |
| InChI Key: | NJADQPPBRWNSRC-DEMYODCQSA-N |