5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-[(furan-2-yl)methyl]-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-[(furan-2-yl)methyl]-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-[(furan-2-yl)methyl]-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-0252 |
| Compound Name: | 5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-[(furan-2-yl)methyl]-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 563.72 |
| Molecular Formula: | C28 H25 N3 O4 S3 |
| Smiles: | CC(c1ccc(c(CSC2=NC3=C(C(N2Cc2ccco2)=O)SC(N3CCc2ccccc2)=S)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4939 |
| logD: | 5.4939 |
| logSw: | -5.4076 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 57.362 |
| InChI Key: | HYWCMWHKRAPNMG-UHFFFAOYSA-N |