3-amino-2-{[1-(cyclopentylamino)-1-oxobutan-2-yl]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-{[1-(cyclopentylamino)-1-oxobutan-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-amino-2-{[1-(cyclopentylamino)-1-oxobutan-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K285-5209 |
| Compound Name: | 3-amino-2-{[1-(cyclopentylamino)-1-oxobutan-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 513.68 |
| Molecular Formula: | C25 H31 N5 O3 S2 |
| Smiles: | CCC(C(NC1CCCC1)=O)SC1=Nc2c(C(N1N)=O)c(C)c(C(Nc1ccc(C)cc1C)=O)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4687 |
| logD: | 4.4667 |
| logSw: | -4.4806 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 89.62 |
| InChI Key: | YSXVNLBJITZEAY-SFHVURJKSA-N |