3-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-[5-(2-thienylmethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-[5-(2-thienylmethyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-[5-(2-thienylmethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C370-4920 |
| Compound Name: | 3-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-[5-(2-thienylmethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 451.95 |
| Molecular Formula: | C21 H14 Cl N5 O S2 |
| Smiles: | C(c1cccs1)c1nnc(NC(C(=C/c2cccn2c2ccc(cc2)[Cl])\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.29 |
| logD: | 4 |
| logSw: | -6.35 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 132.72 |
| InChI Key: | DPFACNLZMLLLSN-UHFFFAOYSA-N |