2,4-bis[(2,4,5-trimethoxyphenyl)methylidene]thiolan-3-one
Chemical Structure Depiction of
2,4-bis[(2,4,5-trimethoxyphenyl)methylidene]thiolan-3-one
2,4-bis[(2,4,5-trimethoxyphenyl)methylidene]thiolan-3-one
Compound characteristics
| Compound ID: | C249-0109 |
| Compound Name: | 2,4-bis[(2,4,5-trimethoxyphenyl)methylidene]thiolan-3-one |
| Molecular Weight: | 458.53 |
| Molecular Formula: | C24 H26 O7 S |
| Smiles: | COc1cc(c(cc1/C=C1CSC(=C/c2cc(c(cc2OC)OC)OC)\C/1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6677 |
| logD: | 3.6677 |
| logSw: | -3.8539 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.182 |
| InChI Key: | XQINTRUKOKKFCN-UHFFFAOYSA-N |