2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C370-3662 |
| Compound Name: | 2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide |
| Molecular Weight: | 394.41 |
| Molecular Formula: | C18 H14 N6 O3 S |
| Smiles: | CCc1nnc(NC(C(=C/c2cccn2c2ccc(cc2)[N+]([O-])=O)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.97 |
| logD: | 2.13 |
| logSw: | -5.02 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 227.24 |
| InChI Key: | ZXKIKINFZRQOBF-UHFFFAOYSA-N |