4-butyl-6-chloro-9-[2-(3,4-dimethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
4-butyl-6-chloro-9-[2-(3,4-dimethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
4-butyl-6-chloro-9-[2-(3,4-dimethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0411 |
| Compound Name: | 4-butyl-6-chloro-9-[2-(3,4-dimethoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 457.95 |
| Molecular Formula: | C25 H28 Cl N O5 |
| Smiles: | CCCCC1=CC(=O)Oc2c1cc(c1c2CN(CCc2ccc(c(c2)OC)OC)CO1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4755 |
| logD: | 5.386 |
| logSw: | -6.0191 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.838 |
| InChI Key: | OGPCIPXLXIAPPB-UHFFFAOYSA-N |