TL;DR: Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis- (CAS 131706-28-0) is a chemical compound with molecular formula C8H14N6O2 and molecular weight 226.11783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(3-amino-3-oxopropyl)-(1,2,4-triazol-4-yl)amino]propanamide
Also Known As: 4-amino-1,2,4-triazoledipropiondiamide, Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis-, 3-[(3-amino-3-oxopropyl)-(1,2,4-triazol-4-yl)amino]propanamide, 3,3'-((4H-1,2,4-triazol-4-yl)azanediyl)dipropanamide, 3,3'-[(4H-1,2,4-Triazol-4-yl)azanediyl]dipropanamide
| Molecular Formula | C8H14N6O2 |
| Molecular Weight | 226.11783 g/mol |
| XLogP | -2.3 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 226.11783 Da |
| Heavy Atoms | 16 |
| Complexity | 235.0 |
| SMILES | C1=NN=CN1N(CCC(=O)N)CCC(=O)N |
| InChIKey | VNHCEUAHFHWUNE-UHFFFAOYSA-N |
The XLogP value of -2.3 indicates that Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis-. Following Lipinski's Rule of Five, Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis- has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis- is 131706-28-0.
The molecular formula of Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis- is C8H14N6O2.
The molecular weight of Propanamide, 3,3'-(4H-1,2,4-triazol-4-ylimino)bis- is 226.11783 g/mol.
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