3-(4-ethylphenyl)-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-(4-ethylphenyl)-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-(4-ethylphenyl)-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0159 |
| Compound Name: | 3-(4-ethylphenyl)-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C25 H26 N4 O5 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c(C)c(C(N(C)C)=O)sc2N(CC(NCc2ccco2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8121 |
| logD: | 2.8121 |
| logSw: | -3.1812 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.328 |
| InChI Key: | OXIUIXWEEPXSBJ-UHFFFAOYSA-N |