3-(4-chlorophenyl)-5-{[(3-nitrophenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-5-{[(3-nitrophenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(4-chlorophenyl)-5-{[(3-nitrophenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | A0018472 |
| Compound Name: | 3-(4-chlorophenyl)-5-{[(3-nitrophenyl)methyl]sulfanyl}-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 539.05 |
| Molecular Formula: | C24 H15 Cl N4 O3 S3 |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)SC1=NC2=C(C(N1c1ccccc1)=O)SC(N2c1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 5.845 |
| logD: | 5.845 |
| logSw: | -6.1011 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 60.336 |
| InChI Key: | PERKTCLLWNNTMR-UHFFFAOYSA-N |