TL;DR: (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide (CAS 1164496-07-4) is a chemical compound with molecular formula C12H9BrN2OS and molecular weight 307.9619 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-(5-bromo-2-pyridinyl)-3-thiophen-2-ylprop-2-enamide
Also Known As: (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide, (E)-N-(5-Bromopyridin-2-yl)-3-(thiophen-2-yl)acrylamide, (E)-N-(5-bromo-2-pyridyl)-3-(2-thienyl)acrylamide, (E)-N-(5-bromo-2-pyridinyl)-3-thiophen-2-yl-2-propenamide, (Z,2E)-N-(5-bromopyridin-2-yl)-3-(thiophen-2-yl)prop-2-enimidic acid
| Molecular Formula | C12H9BrN2OS |
| Molecular Weight | 307.9619 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.9619 Da |
| Heavy Atoms | 17 |
| Complexity | 298.0 |
| SMILES | C1=CSC(=C1)/C=C/C(=O)NC2=NC=C(C=C2)Br |
| InChIKey | YYCYTYFYPONJSL-GQCTYLIASA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide. Following Lipinski's Rule of Five, (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide is 1164496-07-4.
The molecular formula of (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide is C12H9BrN2OS.
The molecular weight of (E)-N-(5-bromopyridin-2-yl)-3-thiophen-2-ylprop-2-enamide is 307.9619 g/mol.
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