2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-8805 |
| Compound Name: | 2-{[(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 454.18 |
| Molecular Formula: | C17 H14 Br2 N2 O S |
| Smiles: | CC1CCc2c(C#N)c(/N=C/c3cc(cc(c3O)[Br])[Br])sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0711 |
| logD: | 5.9095 |
| logSw: | -5.5949 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.616 |
| InChI Key: | BVDSWUURBXTKSL-SECBINFHSA-N |