5-amino-7-(3-iodophenyl)-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-(3-iodophenyl)-4-(4-methoxyphenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
5-amino-7-(3-iodophenyl)-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: | 8017-2503 |
| Compound Name: | 5-amino-7-(3-iodophenyl)-4-(4-methoxyphenyl)-1,1-dioxo-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile |
| Molecular Weight: | 519.36 |
| Molecular Formula: | C21 H18 I N3 O3 S |
| Smiles: | COc1ccc(cc1)N1C2CCS(C=2C(C(C#N)=C1N)c1cccc(c1)I)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3347 |
| logD: | 3.3347 |
| logSw: | -3.6586 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.564 |
| InChI Key: | PMQROVRQBDSTEE-IBGZPJMESA-N |