methyl 3-amino-2-{[(3-chlorophenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-amino-2-{[(3-chlorophenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
methyl 3-amino-2-{[(3-chlorophenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-5194 |
| Compound Name: | methyl 3-amino-2-{[(3-chlorophenyl)methyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 395.88 |
| Molecular Formula: | C16 H14 Cl N3 O3 S2 |
| Smiles: | Cc1c2C(N(C(=Nc2sc1C(=O)OC)SCc1cccc(c1)[Cl])N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3138 |
| logD: | 3.3138 |
| logSw: | -4.0096 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.624 |
| InChI Key: | COOJLBLUBZUURY-UHFFFAOYSA-N |