6-(2-methoxyphenyl)-5-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
6-(2-methoxyphenyl)-5-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
6-(2-methoxyphenyl)-5-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-0285 |
| Compound Name: | 6-(2-methoxyphenyl)-5-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 538.73 |
| Molecular Formula: | C25 H22 N4 O2 S4 |
| Smiles: | Cc1nc(CSC2=NC3=C(C(N2c2ccccc2OC)=O)SC(N3CCc2ccccc2)=S)cs1 |
| Stereo: | ACHIRAL |
| logP: | 5.5346 |
| logD: | 5.5346 |
| logSw: | -5.3225 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 45.181 |
| InChI Key: | LUZFXTGKBUMMGV-UHFFFAOYSA-N |