2-{[(5-bromo-2,4-dihydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-{[(5-bromo-2,4-dihydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-{[(5-bromo-2,4-dihydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-2564 |
| Compound Name: | 2-{[(5-bromo-2,4-dihydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 377.26 |
| Molecular Formula: | C16 H13 Br N2 O2 S |
| Smiles: | C1CCc2c(C1)c(C#N)c(/N=C/c1cc(c(cc1O)O)[Br])s2 |
| Stereo: | ACHIRAL |
| logP: | 4.1699 |
| logD: | 4.129 |
| logSw: | -4.0938 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.233 |
| InChI Key: | HHFNSCYTYPBHFT-UHFFFAOYSA-N |