3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C370-3529 |
| Compound Name: | 3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 400.25 |
| Molecular Formula: | C16 H10 Br N5 O S |
| Smiles: | C(=C(/C#N)C(Nc1nncs1)=O)\c1cccn1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.79 |
| logD: | 2.95 |
| logSw: | -4.55 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 142.51 |
| InChI Key: | FOIONJAEJNJKIK-UHFFFAOYSA-N |