5'-Deoxy-5'-chloroformycin
TL;DR: 5'-Deoxy-5'-chloroformycin (CAS 72453-27-1) is a chemical compound with molecular formula C10H12ClN5O3 and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S,5S)-2-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(chloromethyl)oxolane-3,4-diol
Also Known As: 5'-Deoxy-5'-chloroformycin, 5'-Deoxy-5'-chloroformycin A, KST-1A8074, (1xi)-1-(7-amino-2h-pyrazolo[4,3-d]pyrimidin-3-yl)-1,4-anhydro-5-chloro-5-deoxy-d-ribitol, (3R,4S,5S)-2-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(chloromethyl)oxolane-3,4-diol
| Molecular Formula | C10H12ClN5O3 |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.06287 |
| Heavy Atoms | 19 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 72453-27-1 |
|---|---|
| SMILES | C1=NC2=C(NN=C2C(=N1)N)C3[C@@H]([C@@H]([C@H](O3)CCl)O)O |
| InChIKey | YTYTYXVZBHJYMY-NPHNYOHOSA-N |
Product Overview
5'-Deoxy-5'-chloroformycin (CAS 72453-27-1), with molecular formula C10H12ClN5O3 and molecular weight 285.06 g/mol. IUPAC: (3R,4S,5S)-2-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(chloromethyl)oxolane-3,4-diol.
Chemical Property Profile of 5'-Deoxy-5'-chloroformycin
Property Insights of 5'-Deoxy-5'-chloroformycin
The XLogP value of -1.5 indicates that 5'-Deoxy-5'-chloroformycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-Deoxy-5'-chloroformycin. Following Lipinski's Rule of Five, 5'-Deoxy-5'-chloroformycin has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5'-Deoxy-5'-chloroformycin?
The CAS number of 5'-Deoxy-5'-chloroformycin is 72453-27-1.
What is the molecular formula of 5'-Deoxy-5'-chloroformycin?
The molecular formula of 5'-Deoxy-5'-chloroformycin is C10H12ClN5O3.
What is the molecular weight of 5'-Deoxy-5'-chloroformycin?
The molecular weight of 5'-Deoxy-5'-chloroformycin is 285.06 g/mol.
Where can I buy 5'-Deoxy-5'-chloroformycin?
You can request a quote for 5'-Deoxy-5'-chloroformycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-Deoxy-5'-chloroformycin?
Yes, KEHONG BIO provides custom synthesis services for 5'-Deoxy-5'-chloroformycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.