6-chloro-4-propyl-7-[(3,4,5-trimethoxyphenyl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-4-propyl-7-[(3,4,5-trimethoxyphenyl)methoxy]-2H-1-benzopyran-2-one
6-chloro-4-propyl-7-[(3,4,5-trimethoxyphenyl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0119 |
| Compound Name: | 6-chloro-4-propyl-7-[(3,4,5-trimethoxyphenyl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 418.87 |
| Molecular Formula: | C22 H23 Cl O6 |
| Smiles: | CCCC1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1cc(c(c(c1)OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.0945 |
| logD: | 5.0945 |
| logSw: | -5.3414 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.938 |
| InChI Key: | WKUBEUINCJDMEC-UHFFFAOYSA-N |