3-(4-ethylphenyl)-N,N,5-trimethyl-1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-(4-ethylphenyl)-N,N,5-trimethyl-1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-(4-ethylphenyl)-N,N,5-trimethyl-1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0166 |
| Compound Name: | 3-(4-ethylphenyl)-N,N,5-trimethyl-1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c(C)c(C(N(C)C)=O)sc2N(Cc2ccc(cc2)[N+]([O-])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0034 |
| logD: | 4.0034 |
| logSw: | -4.1836 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.489 |
| InChI Key: | SAPPALQSWPMNFR-UHFFFAOYSA-N |