2-cyano-3-[1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-[1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0091 |
| Compound Name: | 2-cyano-3-[1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C23 H19 N5 O S |
| Smiles: | Cc1cccc(Cn2cc(/C=C(/C#N)C(Nc3nnc(C)s3)=O)c3ccccc23)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.63 |
| logD: | 2.25 |
| logSw: | -5.14 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 139.2 |
| InChI Key: | ZSLWFRWUTDJUDV-UHFFFAOYSA-N |