N-{[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]acetyl}-L-valine
Chemical Structure Depiction of
N-{[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]acetyl}-L-valine
N-{[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]acetyl}-L-valine
Compound characteristics
| Compound ID: | Y042-8688 |
| Compound Name: | N-{[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl)oxy]acetyl}-L-valine |
| Molecular Weight: | 387.43 |
| Molecular Formula: | C21 H25 N O6 |
| Smiles: | CC(C)[C@@H](C(O)=O)NC(COc1cc(C)cc2c1C1CCCCC=1C(=O)O2)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1906 |
| logD: | -1.3965 |
| logSw: | -2.3174 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.898 |
| InChI Key: | KJQCQRGKHLUSAP-IBGZPJMESA-N |