methyl N-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoyl]-D-alaninate
Chemical Structure Depiction of
methyl N-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoyl]-D-alaninate
methyl N-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoyl]-D-alaninate
Compound characteristics
| Compound ID: | Y043-5314 |
| Compound Name: | methyl N-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoyl]-D-alaninate |
| Molecular Weight: | 425.48 |
| Molecular Formula: | C24 H27 N O6 |
| Smiles: | CC1=C(CCC(N[C@H](C)C(=O)OC)=O)C(=O)Oc2c1cc1c3CCCCc3oc1c2C |
| Stereo: | ABSOLUTE |
| logP: | 3.7628 |
| logD: | 3.7628 |
| logSw: | -4.1174 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.001 |
| InChI Key: | ZHTKXJUNEFLTET-CQSZACIVSA-N |