3-{[5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carbonyl]amino}-3-phenylpropanoic acid
Chemical Structure Depiction of
3-{[5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carbonyl]amino}-3-phenylpropanoic acid
3-{[5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carbonyl]amino}-3-phenylpropanoic acid
Compound characteristics
| Compound ID: | 8016-1575 |
| Compound Name: | 3-{[5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carbonyl]amino}-3-phenylpropanoic acid |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C19 H19 N O4 S |
| Smiles: | CC(C)(C#Cc1ccc(C(NC(CC(O)=O)c2ccccc2)=O)s1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5191 |
| logD: | 0.8814 |
| logSw: | -3.5643 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.872 |
| InChI Key: | OABGBAQJPQTJCK-HNNXBMFYSA-N |