6-benzyl-2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile
Chemical Structure Depiction of
6-benzyl-2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile
6-benzyl-2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-0698 |
| Compound Name: | 6-benzyl-2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile |
| Molecular Weight: | 531.27 |
| Molecular Formula: | C22 H17 Br2 N3 O S |
| Smiles: | C1CN(Cc2ccccc2)Cc2c1c(C#N)c(/N=C/c1cc(cc(c1O)[Br])[Br])s2 |
| Stereo: | ACHIRAL |
| logP: | 6.0268 |
| logD: | 5.8652 |
| logSw: | -5.955 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.09 |
| InChI Key: | QVBRHRLFFRLVFW-KBKYJPHKSA-N |