5-amino-7-(3-chlorophenyl)-4-(4-fluorophenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
Chemical Structure Depiction of
5-amino-7-(3-chlorophenyl)-4-(4-fluorophenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
5-amino-7-(3-chlorophenyl)-4-(4-fluorophenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
Compound characteristics
| Compound ID: | 8016-7319 |
| Compound Name: | 5-amino-7-(3-chlorophenyl)-4-(4-fluorophenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile |
| Molecular Weight: | 415.87 |
| Molecular Formula: | C20 H15 Cl F N3 O2 S |
| Smiles: | C1CS(C2C(C(C#N)=C(N)N(C1=2)c1ccc(cc1)F)c1cccc(c1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0017 |
| logD: | 3.0017 |
| logSw: | -3.5427 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.021 |
| InChI Key: | ZSAHNGUMVCFGAC-SFHVURJKSA-N |