methyl N-{[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetyl}glycinate
Chemical Structure Depiction of
methyl N-{[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetyl}glycinate
methyl N-{[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetyl}glycinate
Compound characteristics
| Compound ID: | Y043-5062 |
| Compound Name: | methyl N-{[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetyl}glycinate |
| Molecular Weight: | 389.4 |
| Molecular Formula: | C20 H23 N O7 |
| Smiles: | CC1=CC(=O)Oc2c3CCC(C)(C)Oc3cc(c12)OCC(NCC(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.172 |
| logD: | 2.172 |
| logSw: | -2.5606 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.299 |
| InChI Key: | MDXVYHVIEXBDNE-UHFFFAOYSA-N |