N-({[6-ethyl-4-oxo-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-4H-1-benzopyran-7-yl]oxy}acetyl)-L-tryptophan
Chemical Structure Depiction of
N-({[6-ethyl-4-oxo-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-4H-1-benzopyran-7-yl]oxy}acetyl)-L-tryptophan
N-({[6-ethyl-4-oxo-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-4H-1-benzopyran-7-yl]oxy}acetyl)-L-tryptophan
Compound characteristics
| Compound ID: | Y041-1345 |
| Compound Name: | N-({[6-ethyl-4-oxo-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-4H-1-benzopyran-7-yl]oxy}acetyl)-L-tryptophan |
| Molecular Weight: | 577.6 |
| Molecular Formula: | C32 H27 N5 O6 |
| Smiles: | CCc1cc2C(C(=COc2cc1OCC(N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)=O)c1nncn1c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8538 |
| logD: | -0.7368 |
| logSw: | -3.2735 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.37 |
| InChI Key: | WZNYQIKYTXNSNF-SANMLTNESA-N |