2-cyano-3-[1-(4-methylbenzyl)-1H-indol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(4-methylbenzyl)-1H-indol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-[1-(4-methylbenzyl)-1H-indol-3-yl]-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0092 |
| Compound Name: | 2-cyano-3-[1-(4-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: | Cc1ccc(Cn2cc(/C=C(/C#N)C(Nc3nnc(C)s3)=O)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.41 |
| logD: | 2.03 |
| logSw: | -4.95 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 144.85 |
| InChI Key: | JBRSSZCFMMSGOB-UHFFFAOYSA-N |