TL;DR: 2-Methyl-4-(3-pyridyl)thiazole (CAS 122845-35-6) is a chemical compound with molecular formula C9H8N2S and molecular weight 176.04082 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-4-pyridin-3-yl-1,3-thiazole
Also Known As: 2-Methyl-4-(3-pyridyl)thiazole, Pyridine, 3-(2-methyl-4-thiazolyl)-, 2-methyl-4-(pyridin-3-yl)-thiazole, 2-Methyl-4-(pyridin-3-yl)thiazole, 2-methyl-4-pyridin-3-yl-1,3-thiazole
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H8N2S |
| Molecular Weight | 176.04082 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.04082 Da |
| Heavy Atoms | 12 |
| Complexity | 151.0 |
| SMILES | CC1=NC(=CS1)C2=CN=CC=C2 |
| InChIKey | PVUGYBMZXNBOPD-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4-(3-pyridyl)thiazole. With a topological polar surface area (TPSA) of 54.0 Ų, 2-Methyl-4-(3-pyridyl)thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-(3-pyridyl)thiazole has 0 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-Methyl-4-(3-pyridyl)thiazole is 122845-35-6.
The molecular formula of 2-Methyl-4-(3-pyridyl)thiazole is C9H8N2S.
The molecular weight of 2-Methyl-4-(3-pyridyl)thiazole is 176.04082 g/mol.
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