TL;DR: 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide (CAS 107933-04-0) is a chemical compound with molecular formula C8H8N4S and molecular weight 192.04697 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide
Also Known As: 3H-Imidazo[4,5-b]pyridine-2-ethanethioamide, 3H-Imidazo[4,5-b]pyridine-2-thioacetamide, AE-842/31980045, 2-(1H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide, 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide
| Molecular Formula | C8H8N4S |
| Molecular Weight | 192.04697 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 99.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.04697 Da |
| Heavy Atoms | 13 |
| Complexity | 208.0 |
| SMILES | C1=CC2=C(N=C1)N=C(N2)CC(=S)N |
| InChIKey | NMMORSGMWAGIRN-UHFFFAOYSA-N |
The XLogP value of -0.1 indicates that 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide. Following Lipinski's Rule of Five, 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide has 2 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 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide is 107933-04-0.
The molecular formula of 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide is C8H8N4S.
The molecular weight of 2-(3H-imidazo[4,5-b]pyridin-2-yl)ethanethioamide is 192.04697 g/mol.
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