2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C370-3604 |
| Compound Name: | 2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide |
| Molecular Weight: | 380.38 |
| Molecular Formula: | C17 H12 N6 O3 S |
| Smiles: | Cc1nnc(NC(C(=C/c2cccn2c2ccc(cc2)[N+]([O-])=O)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.21 |
| logD: | 1.35 |
| logSw: | -4.35 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 233.27 |
| InChI Key: | MWEZJVCJEQLQEX-UHFFFAOYSA-N |