N-(2-cyanophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2-cyanophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
N-(2-cyanophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | C243-0071 |
| Compound Name: | N-(2-cyanophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 346.36 |
| Molecular Formula: | C18 H10 N4 O2 S |
| Smiles: | C1C=CN2C(C=1)=Nc1c(cc(C(Nc3ccccc3C#N)=O)s1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 2.6936 |
| logD: | 2.5756 |
| logSw: | -3.619 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.837 |
| InChI Key: | PEAFWKRQHKFAFW-UHFFFAOYSA-N |