2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C370-4104 |
| Compound Name: | 2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 445.47 |
| Molecular Formula: | C23 H16 F N5 O2 S |
| Smiles: | C(c1nnc(NC(C(=C/c2cccn2c2cccc(c2)F)\C#N)=O)s1)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9 |
| logD: | 2.78 |
| logSw: | -5.77 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 148.68 |
| InChI Key: | HSCAZLMJXVKLKK-UHFFFAOYSA-N |