9-[2-(3,4-diethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-[2-(3,4-diethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-[2-(3,4-diethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D060-0149 |
| Compound Name: | 9-[2-(3,4-diethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 395.45 |
| Molecular Formula: | C23 H25 N O5 |
| Smiles: | CCOc1ccc(CCN2Cc3c(ccc4C=CC(=O)Oc34)OC2)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.437 |
| logD: | 3.3945 |
| logSw: | -3.7752 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.313 |
| InChI Key: | CMSXKNVTPCPTMQ-UHFFFAOYSA-N |