1-[(3-chlorophenyl)methyl]-N,N,5-trimethyl-2,4-dioxo-3-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-N,N,5-trimethyl-2,4-dioxo-3-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
1-[(3-chlorophenyl)methyl]-N,N,5-trimethyl-2,4-dioxo-3-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0378 |
| Compound Name: | 1-[(3-chlorophenyl)methyl]-N,N,5-trimethyl-2,4-dioxo-3-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 521.94 |
| Molecular Formula: | C24 H19 Cl F3 N3 O3 S |
| Smiles: | Cc1c2C(N(C(N(Cc3cccc(c3)[Cl])c2sc1C(N(C)C)=O)=O)c1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8252 |
| logD: | 4.8252 |
| logSw: | -5.012 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.807 |
| InChI Key: | NKKDFJOQSJUQIM-UHFFFAOYSA-N |