2-{[(3,5-diiodo-4-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-{[(3,5-diiodo-4-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-{[(3,5-diiodo-4-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-5538 |
| Compound Name: | 2-{[(3,5-diiodo-4-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 548.18 |
| Molecular Formula: | C17 H14 I2 N2 O S |
| Smiles: | COc1c(cc(/C=N/c2c(C#N)c3CCCCc3s2)cc1I)I |
| Stereo: | ACHIRAL |
| logP: | 5.9136 |
| logD: | 5.9136 |
| logSw: | -5.5818 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 32.854 |
| InChI Key: | GNADMKARWVHKMT-UHFFFAOYSA-N |