TL;DR: 2-(Ethylthio)-9H-purin-6-amine (CAS 143621-35-6) is a chemical compound with molecular formula C7H9N5S and molecular weight 195.05786 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethylsulfanyl-7H-purin-6-amine
Also Known As: 2-(Ethylthio)-9H-purin-6-amine, 2-ethylthioadenine, 2-ethylsulfanyl-7H-purin-6-amine, 2-(ethylsulfanyl)-9H-purin-6-amine, 2-ethylsulfanyl-5H-purin-6-amine
| Molecular Formula | C7H9N5S |
| Molecular Weight | 195.05786 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.05786 Da |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
| SMILES | CCSC1=NC(=C2C(=N1)N=CN2)N |
| InChIKey | OYUJKXQJBKRXFI-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Ethylthio)-9H-purin-6-amine. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Ethylthio)-9H-purin-6-amine. Following Lipinski's Rule of Five, 2-(Ethylthio)-9H-purin-6-amine 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 2-(Ethylthio)-9H-purin-6-amine is 143621-35-6.
The molecular formula of 2-(Ethylthio)-9H-purin-6-amine is C7H9N5S.
The molecular weight of 2-(Ethylthio)-9H-purin-6-amine is 195.05786 g/mol.
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