3-[1-(4-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[1-(4-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[1-(4-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4011-0345 |
| Compound Name: | 3-[1-(4-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 502.04 |
| Molecular Formula: | C27 H24 Cl N5 O S |
| Smiles: | C1CCC(CC1)c1nnc(NC(C(=C/c2cn(Cc3ccc(cc3)[Cl])c3ccccc23)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.72 |
| logD: | 4.38 |
| logSw: | -6.55 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 134.97 |
| InChI Key: | BJKCMSPOWILSGL-UHFFFAOYSA-N |