3-amino-N-(2,4-dimethylphenyl)-2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-amino-N-(2,4-dimethylphenyl)-2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-amino-N-(2,4-dimethylphenyl)-2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K285-5178 |
| Compound Name: | 3-amino-N-(2,4-dimethylphenyl)-2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 551.69 |
| Molecular Formula: | C27 H29 N5 O4 S2 |
| Smiles: | CCC(C(Nc1cccc(c1)OC)=O)SC1=Nc2c(C(N1N)=O)c(C)c(C(Nc1ccc(C)cc1C)=O)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8762 |
| logD: | 4.8743 |
| logSw: | -4.7223 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 95.75 |
| InChI Key: | ZIDJZVSQMHAMGT-FQEVSTJZSA-N |