3-(4-tert-butylphenyl)-3-(2-methyl-3-nitrobenzamido)propanoic acid
Chemical Structure Depiction of
3-(4-tert-butylphenyl)-3-(2-methyl-3-nitrobenzamido)propanoic acid
3-(4-tert-butylphenyl)-3-(2-methyl-3-nitrobenzamido)propanoic acid
Compound characteristics
| Compound ID: | 8015-9250 |
| Compound Name: | 3-(4-tert-butylphenyl)-3-(2-methyl-3-nitrobenzamido)propanoic acid |
| Molecular Weight: | 384.43 |
| Molecular Formula: | C21 H24 N2 O5 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(NC(CC(O)=O)c1ccc(cc1)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.644 |
| logD: | 2.0063 |
| logSw: | -4.3377 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.747 |
| InChI Key: | MEFVZYJIERFYIM-KRWDZBQOSA-N |