5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,6-diphenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,6-diphenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,6-diphenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-0019 |
| Compound Name: | 5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,6-diphenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 522.07 |
| Molecular Formula: | C25 H16 Cl N3 O2 S3 |
| Smiles: | C(C(c1ccc(cc1)[Cl])=O)SC1=NC2=C(C(N1c1ccccc1)=O)SC(N2c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.3865 |
| logD: | 5.3865 |
| logSw: | -6.0726 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 40.201 |
| InChI Key: | LDLRZPSKXDLEBD-UHFFFAOYSA-N |