2-({[2-(benzyloxy)-3,5-diiodophenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-({[2-(benzyloxy)-3,5-diiodophenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-({[2-(benzyloxy)-3,5-diiodophenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-4996 |
| Compound Name: | 2-({[2-(benzyloxy)-3,5-diiodophenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 624.28 |
| Molecular Formula: | C23 H18 I2 N2 O S |
| Smiles: | C1CCc2c(C1)c(C#N)c(/N=C/c1cc(cc(c1OCc1ccccc1)I)I)s2 |
| Stereo: | ACHIRAL |
| logP: | 7.8873 |
| logD: | 7.8873 |
| logSw: | -6.2742 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 32.538 |
| InChI Key: | KPNXRQAKGBSASD-UHFFFAOYSA-N |