3-(5-bromo-2-methoxyphenyl)-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-(5-bromo-2-methoxyphenyl)-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
3-(5-bromo-2-methoxyphenyl)-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-2161 |
| Compound Name: | 3-(5-bromo-2-methoxyphenyl)-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 407.29 |
| Molecular Formula: | C16 H15 Br N4 O2 S |
| Smiles: | CCCc1nnc(NC(C(=C/c2cc(ccc2OC)[Br])\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.57 |
| logD: | 2.94 |
| logSw: | -5.43 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 140.22 |
| InChI Key: | NYPKJIFRTJGLNB-UHFFFAOYSA-N |