methyl 3-amino-2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-amino-2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
methyl 3-amino-2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-5197 |
| Compound Name: | methyl 3-amino-2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C20 H23 N3 O3 S2 |
| Smiles: | Cc1c2C(N(C(=Nc2sc1C(=O)OC)SCc1ccc(cc1)C(C)(C)C)N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1753 |
| logD: | 4.1753 |
| logSw: | -4.5067 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.624 |
| InChI Key: | DXFRENBCPLXVSD-UHFFFAOYSA-N |