N-{2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]propanoyl}tryptophan
Chemical Structure Depiction of
N-{2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]propanoyl}tryptophan
N-{2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]propanoyl}tryptophan
Compound characteristics
| Compound ID: | Y040-8425 |
| Compound Name: | N-{2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]propanoyl}tryptophan |
| Molecular Weight: | 488.54 |
| Molecular Formula: | C28 H28 N2 O6 |
| Smiles: | CC(C(N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)=O)Oc1cc(C)cc2c1C1CCCCC=1C(=O)O2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8935 |
| logD: | 0.3029 |
| logSw: | -4.1125 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.279 |
| InChI Key: | PVIRABOQPMUYOT-XLDIYJRPSA-N |