2-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
2-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 5784-0723 |
| Compound Name: | 2-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile |
| Molecular Weight: | 378.28 |
| Molecular Formula: | C17 H13 Cl2 N3 O S |
| Smiles: | C1CN2CCC1c1c(C#N)c(/N=C/c3cc(cc(c3O)[Cl])[Cl])sc12 |
| Stereo: | ACHIRAL |
| logP: | 4.8075 |
| logD: | 4.6402 |
| logSw: | -4.5334 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.854 |
| InChI Key: | JIBMKRBVTZATBB-UHFFFAOYSA-N |