3-(2-chloro-5-nitrophenyl)-3-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]propanoic acid
Chemical Structure Depiction of
3-(2-chloro-5-nitrophenyl)-3-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]propanoic acid
3-(2-chloro-5-nitrophenyl)-3-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]propanoic acid
Compound characteristics
| Compound ID: | 8015-6189 |
| Compound Name: | 3-(2-chloro-5-nitrophenyl)-3-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]propanoic acid |
| Molecular Weight: | 429.82 |
| Molecular Formula: | C20 H16 Cl N3 O6 |
| Smiles: | Cc1c(C(NC(CC(O)=O)c2cc(ccc2[Cl])[N+]([O-])=O)=O)c(c2ccccc2)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9565 |
| logD: | 0.3188 |
| logSw: | -3.483 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.008 |
| InChI Key: | PETPJIULZSABHA-INIZCTEOSA-N |