2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)methyl]benzonitrile
Chemical Structure Depiction of
2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)methyl]benzonitrile
2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)methyl]benzonitrile
Compound characteristics
| Compound ID: | 3270-0716 |
| Compound Name: | 2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)methyl]benzonitrile |
| Molecular Weight: | 545.66 |
| Molecular Formula: | C33 H27 N3 O3 S |
| Smiles: | COc1cc(/C=C2/C(N(Cc3ccccc3)\C(=N/Cc3ccccc3)S2)=O)ccc1OCc1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 6.6428 |
| logD: | 6.6428 |
| logSw: | -5.7395 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.383 |
| InChI Key: | AWEXPKVXWMGXGL-UHFFFAOYSA-N |