2-({[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-({[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-({[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 0848-0154 |
| Compound Name: | 2-({[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C19 H18 N2 O S |
| Smiles: | C=CCc1cccc(/C=N/c2c(C#N)c3CCCCc3s2)c1O |
| Stereo: | ACHIRAL |
| logP: | 5.1775 |
| logD: | 5.1763 |
| logSw: | -5.2692 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.616 |
| InChI Key: | KXYVKWIQJDJPNI-UHFFFAOYSA-N |