N-{2-[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}isoleucine
Chemical Structure Depiction of
N-{2-[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}isoleucine
N-{2-[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}isoleucine
Compound characteristics
| Compound ID: | D715-0597 |
| Compound Name: | N-{2-[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoyl}isoleucine |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C22 H27 N O6 |
| Smiles: | CC[C@@H](C)[C@@H](C(O)=O)NC(C(C)Oc1ccc2C3CCCCC=3C(=O)Oc2c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1771 |
| logD: | -1.41 |
| logSw: | -2.823 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.315 |
| InChI Key: | MGHCIGMRLGCRMV-IYRHBAIHSA-N |