2-cyano-N~1~-[5-(isobutylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[5-(isobutylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide
2-cyano-N~1~-[5-(isobutylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide
Compound characteristics
| Compound ID: | C356-1275 |
| Compound Name: | 2-cyano-N~1~-[5-(isobutylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C19 H19 N5 O3 S2 |
| Smiles: | CC(C)CS(c1nnc(NC(C(=C/c2c3ccccc3[nH]c2C)\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.94 |
| logD: | 1.87 |
| logSw: | -5.01 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 218.39 |
| InChI Key: | RJUGRSWADDSIAK-UHFFFAOYSA-N |