2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-bromophenoxy)methyl]benzonitrile
Chemical Structure Depiction of
2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-bromophenoxy)methyl]benzonitrile
2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-bromophenoxy)methyl]benzonitrile
Compound characteristics
| Compound ID: | 3270-0714 |
| Compound Name: | 2-[(4-{[3-benzyl-2-(benzylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-bromophenoxy)methyl]benzonitrile |
| Molecular Weight: | 594.53 |
| Molecular Formula: | C32 H24 Br N3 O2 S |
| Smiles: | C(c1ccccc1)/N=C1\N(Cc2ccccc2)C(/C(=C/c2ccc(c(c2)[Br])OCc2ccccc2C#N)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4201 |
| logD: | 7.4201 |
| logSw: | -6.1582 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.753 |
| InChI Key: | KSMOSUPTVUZEFT-UHFFFAOYSA-N |