3-(4-chlorophenyl)-1-[(2-cyanophenyl)methyl]-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-[(2-cyanophenyl)methyl]-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-(4-chlorophenyl)-1-[(2-cyanophenyl)methyl]-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0018 |
| Compound Name: | 3-(4-chlorophenyl)-1-[(2-cyanophenyl)methyl]-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 478.96 |
| Molecular Formula: | C24 H19 Cl N4 O3 S |
| Smiles: | Cc1c2C(N(C(N(Cc3ccccc3C#N)c2sc1C(N(C)C)=O)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4071 |
| logD: | 3.4071 |
| logSw: | -4.3098 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.164 |
| InChI Key: | CBMVGTPSJHMUKG-UHFFFAOYSA-N |