5-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-4136 |
| Compound Name: | 5-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-ethoxyphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 538.11 |
| Molecular Formula: | C26 H20 Cl N3 O2 S3 |
| Smiles: | CCOc1ccc(cc1)N1C2=C(C(N(C(=N2)SCc2cccc(c2)[Cl])c2ccccc2)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 6.4126 |
| logD: | 6.4126 |
| logSw: | -6.1016 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 34.078 |
| InChI Key: | OHGMLSFYNXBVCI-UHFFFAOYSA-N |