2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide
2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide
Compound characteristics
| Compound ID: | C355-1235 |
| Compound Name: | 2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(2-methyl-1H-indol-3-yl)acrylamide |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C18 H17 N5 O3 S2 |
| Smiles: | CC(C)S(c1nc(NC(C(=C/c2c3ccccc3[nH]c2C)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.28 |
| logD: | 1.21 |
| logSw: | -4.24 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 207.16 |
| InChI Key: | OBWUBUCFXJWETP-UHFFFAOYSA-N |