4,8,8-trimethyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one
Chemical Structure Depiction of
4,8,8-trimethyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one
4,8,8-trimethyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one
Compound characteristics
| Compound ID: | Y041-0540 |
| Compound Name: | 4,8,8-trimethyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one |
| Molecular Weight: | 371.43 |
| Molecular Formula: | C21 H25 N O5 |
| Smiles: | CC1=CC(=O)Oc2c3CCC(C)(C)Oc3cc(c12)OCC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9601 |
| logD: | 2.9601 |
| logSw: | -3.2147 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.736 |
| InChI Key: | OWPRYDZHAICDHQ-UHFFFAOYSA-N |