2-cyano-3-{1-[2-(3,5-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{1-[2-(3,5-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{1-[2-(3,5-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0304 |
| Compound Name: | 2-cyano-3-{1-[2-(3,5-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C25 H23 N5 O2 S |
| Smiles: | Cc1cc(C)cc(c1)OCCn1cc(/C=C(/C#N)C(Nc2nnc(C)s2)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.07 |
| logD: | 2.7 |
| logSw: | -5.9 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 156.6 |
| InChI Key: | CTXNYFHUVQHGFA-UHFFFAOYSA-N |