5-amino-7-(4-fluorophenyl)-4-(4-methoxyphenyl)-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-(4-fluorophenyl)-4-(4-methoxyphenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
5-amino-7-(4-fluorophenyl)-4-(4-methoxyphenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
Compound characteristics
| Compound ID: | 8017-2500 |
| Compound Name: | 5-amino-7-(4-fluorophenyl)-4-(4-methoxyphenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile |
| Molecular Weight: | 411.45 |
| Molecular Formula: | C21 H18 F N3 O3 S |
| Smiles: | COc1ccc(cc1)N1C2CCS(C=2C(C(C#N)=C1N)c1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.389 |
| logD: | 2.389 |
| logSw: | -2.7197 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.564 |
| InChI Key: | IRKKKRGUUYYAFO-IBGZPJMESA-N |