3-[2-(3-methoxyphenyl)-2-oxoethoxy]-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Chemical Structure Depiction of
3-[2-(3-methoxyphenyl)-2-oxoethoxy]-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
3-[2-(3-methoxyphenyl)-2-oxoethoxy]-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Compound characteristics
| Compound ID: | Y040-0869 |
| Compound Name: | 3-[2-(3-methoxyphenyl)-2-oxoethoxy]-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one |
| Molecular Weight: | 392.45 |
| Molecular Formula: | C24 H24 O5 |
| Smiles: | Cc1c(ccc2C3CCCCCC=3C(=O)Oc12)OCC(c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3924 |
| logD: | 5.3924 |
| logSw: | -5.3986 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.201 |
| InChI Key: | SSWLETGZKJNHQP-UHFFFAOYSA-N |