TL;DR: 8-chloro-N-methyl-7H-purin-6-amine (CAS 100367-41-7) is a chemical compound with molecular formula C6H6ClN5 and molecular weight 183.03117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-chloro-N-methyl-7H-purin-6-amine
Also Known As: 8-chloro-N-methyl-7H-purin-6-amine, 8-Chloro-N-methyl-9H-purin-6-amine, 9H-Purin-6-amine, 8-chloro-N-methyl-
| Molecular Formula | C6H6ClN5 |
| Molecular Weight | 183.03117 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.03117 Da |
| Heavy Atoms | 12 |
| Complexity | 166.0 |
| SMILES | CNC1=NC=NC2=C1NC(=N2)Cl |
| InChIKey | WKCPSQUNIKEUBI-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-chloro-N-methyl-7H-purin-6-amine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-chloro-N-methyl-7H-purin-6-amine. Following Lipinski's Rule of Five, 8-chloro-N-methyl-7H-purin-6-amine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 8-chloro-N-methyl-7H-purin-6-amine is 100367-41-7.
The molecular formula of 8-chloro-N-methyl-7H-purin-6-amine is C6H6ClN5.
The molecular weight of 8-chloro-N-methyl-7H-purin-6-amine is 183.03117 g/mol.
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