4-butyl-6-chloro-9-[2-(4-methoxyphenyl)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-(4-methoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
4-butyl-6-chloro-9-[2-(4-methoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0391 |
| Compound Name: | 4-butyl-6-chloro-9-[2-(4-methoxyphenyl)ethyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 427.93 |
| Molecular Formula: | C24 H26 Cl N O4 |
| Smiles: | CCCCC1=CC(=O)Oc2c1cc(c1c2CN(CCc2ccc(cc2)OC)CO1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9408 |
| logD: | 5.7894 |
| logSw: | -6.0718 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.121 |
| InChI Key: | TVCFMNNDYRTOFX-UHFFFAOYSA-N |