3-[(3-fluorophenyl)methyl]-N-(4-iodo-2-methylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-[(3-fluorophenyl)methyl]-N-(4-iodo-2-methylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-[(3-fluorophenyl)methyl]-N-(4-iodo-2-methylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K821-0548 |
| Compound Name: | 3-[(3-fluorophenyl)methyl]-N-(4-iodo-2-methylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 533.36 |
| Molecular Formula: | C22 H17 F I N3 O2 S |
| Smiles: | Cc1cc(ccc1NC(c1c(C)c2C(N(Cc3cccc(c3)F)C=Nc2s1)=O)=O)I |
| Stereo: | ACHIRAL |
| logP: | 5.137 |
| logD: | 5.0522 |
| logSw: | -5.1608 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.635 |
| InChI Key: | JIOOECHDUAMPLP-UHFFFAOYSA-N |