3-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-3-(3-nitrophenyl)propanoic acid
Chemical Structure Depiction of
3-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-3-(3-nitrophenyl)propanoic acid
3-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-3-(3-nitrophenyl)propanoic acid
Compound characteristics
| Compound ID: | 8015-3278 |
| Compound Name: | 3-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-3-(3-nitrophenyl)propanoic acid |
| Molecular Weight: | 429.82 |
| Molecular Formula: | C20 H16 Cl N3 O6 |
| Smiles: | Cc1c(C(NC(CC(O)=O)c2cccc(c2)[N+]([O-])=O)=O)c(c2ccccc2[Cl])no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7321 |
| logD: | 0.0944 |
| logSw: | -3.4211 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.008 |
| InChI Key: | BWBYUVWNQFTRDU-INIZCTEOSA-N |