1,3-dimethyl-6-{[3-(trifluoromethyl)anilino]methyl}[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1,3-dimethyl-6-{[3-(trifluoromethyl)anilino]methyl}[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione
1,3-dimethyl-6-{[3-(trifluoromethyl)anilino]methyl}[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8017-1260 |
| Compound Name: | 1,3-dimethyl-6-{[3-(trifluoromethyl)anilino]methyl}[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 409.39 |
| Molecular Formula: | C17 H14 F3 N5 O2 S |
| Smiles: | CN1C(c2c(nc3n2C(CNc2cccc(c2)C(F)(F)F)=CS3)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6657 |
| logD: | 3.6657 |
| logSw: | -4.0199 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.887 |
| InChI Key: | AQWDYKKHJANTDJ-UHFFFAOYSA-N |