TL;DR: 2-Chloro-3-(1-methylethyl)pyrazine (CAS 57674-20-1) is a chemical compound with molecular formula C7H9ClN2 and molecular weight 156.04543 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-3-propan-2-ylpyrazine
Also Known As: 2-Chloro-3-isopropylpyrazine, 2-Chloro-3-(1-methylethyl)pyrazine, 2-CHLORO-3-(PROPAN-2-YL)PYRAZINE, 2-chloro-3-propan-2-ylpyrazine, 2-chloro-3- pyrazine
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H9ClN2 |
| Molecular Weight | 156.04543 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.04543 Da |
| Heavy Atoms | 10 |
| Complexity | 106.0 |
| SMILES | CC(C)C1=NC=CN=C1Cl |
| InChIKey | BMSLPKADYHPKFF-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-3-(1-methylethyl)pyrazine. With a topological polar surface area (TPSA) of 25.8 Ų, 2-Chloro-3-(1-methylethyl)pyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-3-(1-methylethyl)pyrazine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Chloro-3-(1-methylethyl)pyrazine is 57674-20-1.
The molecular formula of 2-Chloro-3-(1-methylethyl)pyrazine is C7H9ClN2.
The molecular weight of 2-Chloro-3-(1-methylethyl)pyrazine is 156.04543 g/mol.
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