5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | F092-0063 |
| Compound Name: | 5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 447.98 |
| Molecular Formula: | C19 H14 Cl N3 O2 S3 |
| Smiles: | COc1cccc(c1)N1C2=C(C(NC(=N2)SCc2ccccc2[Cl])=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 4.7106 |
| logD: | 4.7099 |
| logSw: | -4.8479 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.84 |
| InChI Key: | GKIBZKVKWHJSDK-UHFFFAOYSA-N |