3-amino-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-amino-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-amino-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K285-5182 |
| Compound Name: | 3-amino-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 503.02 |
| Molecular Formula: | C23 H20 Cl F N4 O2 S2 |
| Smiles: | Cc1ccc(c(C)c1)NC(c1c(C)c2C(N(C(=Nc2s1)SCc1c(cccc1[Cl])F)N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1501 |
| logD: | 5.1481 |
| logSw: | -5.7689 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.844 |
| InChI Key: | DOPDBHCMIHIBPT-UHFFFAOYSA-N |