5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-(pyridin-3-yl)-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
Chemical Structure Depiction of
5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-(pyridin-3-yl)-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-(pyridin-3-yl)-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
Compound characteristics
| Compound ID: | 8017-2505 |
| Compound Name: | 5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-(pyridin-3-yl)-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C20 H18 N4 O3 S |
| Smiles: | COc1ccc(cc1)N1C2CCS(C=2C(C(C#N)=C1N)c1cccnc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2803 |
| logD: | 1.2803 |
| logSw: | -1.5401 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.082 |
| InChI Key: | INQQESPHMWKLJU-SFHVURJKSA-N |