3-(4-tert-butylphenyl)-3-(2-chloro-4-nitrobenzamido)propanoic acid
Chemical Structure Depiction of
3-(4-tert-butylphenyl)-3-(2-chloro-4-nitrobenzamido)propanoic acid
3-(4-tert-butylphenyl)-3-(2-chloro-4-nitrobenzamido)propanoic acid
Compound characteristics
| Compound ID: | 8015-9249 |
| Compound Name: | 3-(4-tert-butylphenyl)-3-(2-chloro-4-nitrobenzamido)propanoic acid |
| Molecular Weight: | 404.85 |
| Molecular Formula: | C20 H21 Cl N2 O5 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(CC(O)=O)NC(c1ccc(cc1[Cl])[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8791 |
| logD: | 2.2414 |
| logSw: | -4.7418 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.048 |
| InChI Key: | SVDXCIBHYOFAEV-KRWDZBQOSA-N |