N-{2-[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}phenylalanine
Chemical Structure Depiction of
N-{2-[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}phenylalanine
N-{2-[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}phenylalanine
Compound characteristics
| Compound ID: | Y042-8682 |
| Compound Name: | N-{2-[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}phenylalanine |
| Molecular Weight: | 449.5 |
| Molecular Formula: | C26 H27 N O6 |
| Smiles: | CC(C(N[C@@H](Cc1ccccc1)C(O)=O)=O)Oc1ccc2C3CCCCC=3C(=O)Oc2c1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4017 |
| logD: | -0.1889 |
| logSw: | -3.575 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.092 |
| InChI Key: | QVTYWGMYZTWEPJ-MRNPHLECSA-N |