3-(4-chlorophenyl)-1-[1-(2-ethoxyanilino)-1-oxobutan-2-yl]-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-(4-chlorophenyl)-1-[1-(2-ethoxyanilino)-1-oxobutan-2-yl]-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-(4-chlorophenyl)-1-[1-(2-ethoxyanilino)-1-oxobutan-2-yl]-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0010 |
| Compound Name: | 3-(4-chlorophenyl)-1-[1-(2-ethoxyanilino)-1-oxobutan-2-yl]-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 569.08 |
| Molecular Formula: | C28 H29 Cl N4 O5 S |
| Smiles: | CCC(C(Nc1ccccc1OCC)=O)N1C(N(C(c2c(C)c(C(N(C)C)=O)sc12)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2336 |
| logD: | 4.2335 |
| logSw: | -4.8468 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.908 |
| InChI Key: | VIYGHVKVLLDXNO-FQEVSTJZSA-N |