TL;DR: 9-(2',3'-Dihydroxycyclopent-4'-enyl)adenine (CAS 112318-09-9) is a chemical compound with molecular formula C10H11N5O2 and molecular weight 233.09128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(6-aminopurin-9-yl)cyclopent-3-ene-1,2-diol
Also Known As: DHCeA, 5'-Norneplanocin A, 5'-Dhca, TTDHC, 5-(6-aminopurin-9-yl)cyclopent-3-ene-1,2-diol
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H11N5O2 |
| Molecular Weight | 233.09128 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.09128 Da |
| Heavy Atoms | 17 |
| Complexity | 326.0 |
| SMILES | C1=CC(C(C1N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | RQPALADHFYHEHK-UHFFFAOYSA-N |
The XLogP value of -0.9 indicates that 9-(2',3'-Dihydroxycyclopent-4'-enyl)adenine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(2',3'-Dihydroxycyclopent-4'-enyl)adenine. Following Lipinski's Rule of Five, 9-(2',3'-Dihydroxycyclopent-4'-enyl)adenine has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 9-(2',3'-Dihydroxycyclopent-4'-enyl)adenine is 112318-09-9.
The molecular formula of 9-(2',3'-Dihydroxycyclopent-4'-enyl)adenine is C10H11N5O2.
The molecular weight of 9-(2',3'-Dihydroxycyclopent-4'-enyl)adenine is 233.09128 g/mol.
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