N-(2-chloro-4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(2-chloro-4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | F993-0300 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 367.78 |
| Molecular Formula: | C15 H11 Cl F N3 O3 S |
| Smiles: | CN1C(c2cc(C(Nc3ccc(cc3[Cl])F)=O)sc2N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3142 |
| logD: | 3.181 |
| logSw: | -3.7068 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.186 |
| InChI Key: | XBSWTGHGTCHFAE-UHFFFAOYSA-N |