Caldariomycin
TL;DR: Caldariomycin (CAS 465-61-2) is a chemical compound with molecular formula C5H8Cl2O2 and molecular weight 169.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1S,3S)-2,2-dichlorocyclopentane-1,3-diol
Also Known As: CALDARIOMYCIN, LUTEIG, CALDARIOMYCIN [MI], (1S,3S)-2,2-dichlorocyclopentane-1,3-diol, 1,3-Cyclopentanediol, 2,2-dichloro-, (1S-trans)-
| Molecular Formula | C5H8Cl2O2 |
|---|---|
| Molecular Weight | 169.99 g/mol |
| LogP | 0.6759 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 169.99013 |
| Heavy Atoms | 9 |
| Complexity | 103.52562 |
Chemical Identifiers
| CAS Number | 465-61-2 |
|---|---|
| SMILES | C1C[C@@H](C([C@H]1O)(Cl)Cl)O |
Product Overview
Caldariomycin (CAS 465-61-2), with molecular formula C5H8Cl2O2 and molecular weight 169.99 g/mol. IUPAC: trans-(1S,3S)-2,2-dichlorocyclopentane-1,3-diol.
Chemical Property Profile of Caldariomycin
Property Insights of Caldariomycin
The XLogP value of 0.6759 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Caldariomycin. With a topological polar surface area (TPSA) of 40.46 Ų, Caldariomycin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Caldariomycin has 2 hydrogen bond donor(s) and 2 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 Caldariomycin?
The CAS number of Caldariomycin is 465-61-2.
What is the molecular formula of Caldariomycin?
The molecular formula of Caldariomycin is C5H8Cl2O2.
What is the molecular weight of Caldariomycin?
The molecular weight of Caldariomycin is 169.99 g/mol.
Where can I buy Caldariomycin?
You can request a quote for Caldariomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Caldariomycin?
Yes, KEHONG BIO provides custom synthesis services for Caldariomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.