2-{[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-{[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-{[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8009-0911 |
| Compound Name: | 2-{[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 466.34 |
| Molecular Formula: | C19 H19 I N2 O2 S |
| Smiles: | CCOc1c(cc(/C=N/c2c(C#N)c3CCCCc3s2)cc1I)OC |
| Stereo: | ACHIRAL |
| logP: | 5.4378 |
| logD: | 5.4378 |
| logSw: | -5.3995 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.064 |
| InChI Key: | KTTDDDKTFQDPJG-UHFFFAOYSA-N |