N-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoyl]tryptophan
Chemical Structure Depiction of
N-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoyl]tryptophan
N-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoyl]tryptophan
Compound characteristics
| Compound ID: | 8015-8892 |
| Compound Name: | N-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoyl]tryptophan |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C23 H22 N2 O4 |
| Smiles: | CC(C)(C#Cc1ccc(cc1)C(NC(Cc1c[nH]c2ccccc12)C(O)=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6448 |
| logD: | -0.9977 |
| logSw: | -2.7861 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 78.748 |
| InChI Key: | OXABRYHXDAWPGS-FQEVSTJZSA-N |