3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C370-3587 |
| Compound Name: | 3-[1-(4-bromophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 414.28 |
| Molecular Formula: | C17 H12 Br N5 O S |
| Smiles: | Cc1nnc(NC(C(=C/c2cccn2c2ccc(cc2)[Br])\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.12 |
| logD: | 2.26 |
| logSw: | -5.02 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 145.33 |
| InChI Key: | BQCVRLLBFWGTMW-UHFFFAOYSA-N |