4-butyl-5-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-butyl-5-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2H-1-benzopyran-2-one
4-butyl-5-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-1726 |
| Compound Name: | 4-butyl-5-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C23 H24 O5 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(C)cc(c12)OCC(c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3003 |
| logD: | 5.3003 |
| logSw: | -5.3091 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.751 |
| InChI Key: | NSODNHVDJPTSJC-UHFFFAOYSA-N |