TL;DR: coformycin (CAS 11033-22-0) is a chemical compound with molecular formula C11H16N4O5 and molecular weight 284.11206 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(8-hydroxy-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: coformycin, NCI60_002261, 3-pentofuranosyl-3,4,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol, 2-(8-hydroxy-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol, (R)-3,4,7,8-Tetrahydro-3-beta-D-ribofuranosylimidazo(4,5-d)(1,3)diazepin-8-ol
| Molecular Formula | C11H16N4O5 |
| Molecular Weight | 284.11206 g/mol |
| XLogP | -3.1 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.11206 Da |
| Heavy Atoms | 20 |
| Complexity | 384.0 |
| SMILES | C1C(C2=C(NC=N1)N(C=N2)C3C(C(C(O3)CO)O)O)O |
| InChIKey | YOOVTUPUBVHMPG-UHFFFAOYSA-N |
The XLogP value of -3.1 indicates that coformycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for coformycin. Following Lipinski's Rule of Five, coformycin has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of coformycin is 11033-22-0.
The molecular formula of coformycin is C11H16N4O5.
The molecular weight of coformycin is 284.11206 g/mol.
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