6-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
6-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
6-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K258-0006 |
| Compound Name: | 6-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 417.91 |
| Molecular Formula: | C19 H13 Cl F N3 O S2 |
| Smiles: | CC1=NC2=C(C(N1Cc1c(cccc1[Cl])F)=O)SC(N2c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.3253 |
| logD: | 4.3253 |
| logSw: | -4.4612 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 26.1805 |
| InChI Key: | HYKFSGQABIYSLU-UHFFFAOYSA-N |