3-[5-(2-bromo-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[5-(2-bromo-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[5-(2-bromo-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-3938 |
| Compound Name: | 3-[5-(2-bromo-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 488.32 |
| Molecular Formula: | C19 H14 Br N5 O4 S |
| Smiles: | CC(C)c1nnc(NC(C(=C/c2ccc(c3ccc(cc3[Br])[N+]([O-])=O)o2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.57 |
| logD: | 3.64 |
| logSw: | -6.68 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 221.19 |
| InChI Key: | AHABWVZNXUFGRJ-UHFFFAOYSA-N |