3-chloro-7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-chloro-7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-methyl-2H-1-benzopyran-2-one
3-chloro-7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D060-0095 |
| Compound Name: | 3-chloro-7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 358.78 |
| Molecular Formula: | C19 H15 Cl O5 |
| Smiles: | CC1=C(C(=O)Oc2cc(ccc12)OCC(c1ccc(cc1)OC)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.54 |
| logD: | 3.54 |
| logSw: | -3.9448 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.178 |
| InChI Key: | FGWAVUKGKMLTOA-UHFFFAOYSA-N |