2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(1H-indol-3-yl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(1H-indol-3-yl)acrylamide
2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(1H-indol-3-yl)acrylamide
Compound characteristics
| Compound ID: | C355-0600 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(1H-indol-3-yl)acrylamide |
| Molecular Weight: | 387.44 |
| Molecular Formula: | C16 H13 N5 O3 S2 |
| Smiles: | CCS(c1nc(NC(C(=C/c2c[nH]c3ccccc23)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.57 |
| logD: | -0.22 |
| logSw: | -3.86 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 212.5 |
| InChI Key: | KLDVBEORCYRYQI-UHFFFAOYSA-N |