2-{[(2,5-dibromophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-{[(2,5-dibromophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-{[(2,5-dibromophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
Compound ID: | 8002-0681 |
Compound Name: | 2-{[(2,5-dibromophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
Molecular Weight: | 424.15 |
Molecular Formula: | C16 H12 Br2 N2 S |
Smiles: | C1CCc2c(C1)c(C#N)c(/N=C/c1cc(ccc1[Br])[Br])s2 |
Stereo: | ACHIRAL |
logP: | 5.856 |
logD: | 5.856 |
logSw: | -6.0773 |
Hydrogen bond acceptors count: | 2 |
Polar surface area: | 25.137 |
InChI Key: | HBAIVXRTTNQKFO-UHFFFAOYSA-N |