TL;DR: 2'-Deoxycoformycin (CAS 53910-25-1) is a chemical compound with molecular formula C11H16N4O4 and molecular weight 268.11716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol
Also Known As: pentostatin, Vidarbine, 2'-Deoxycoformycin, Deoxycoformycin, Nipent
| Molecular Formula | C11H16N4O4 |
| Molecular Weight | 268.11716 g/mol |
| XLogP | -2.1 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.11716 Da |
| Heavy Atoms | 19 |
| Complexity | 356.0 |
| SMILES | C1C(C(OC1N2C=NC3=C2NC=NCC3O)CO)O |
| InChIKey | FPVKHBSQESCIEP-UHFFFAOYSA-N |
The XLogP value of -2.1 indicates that 2'-Deoxycoformycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-Deoxycoformycin. Following Lipinski's Rule of Five, 2'-Deoxycoformycin has 4 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 2'-Deoxycoformycin is 53910-25-1.
The molecular formula of 2'-Deoxycoformycin is C11H16N4O4.
The molecular weight of 2'-Deoxycoformycin is 268.11716 g/mol.
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