Cambridge id 5528394
TL;DR: Cambridge id 5528394 (CAS 468092-26-4) is a chemical compound with molecular formula C9H11ClN2O5S and molecular weight 294.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitrophenyl)-2-oxo-1,3,2-dioxathian-5-amine;hydrochloride
Also Known As: 4-(4-nitrophenyl)-2-oxo-1,3,2-dioxathian-5-amine Hydrochloride, 5-amino-4-(4-nitrophenyl)-1,3,2-dioxathiane 2-oxide hydrochloride
| Molecular Formula | C9H11ClN2O5S |
|---|---|
| Molecular Weight | 294.01 g/mol |
| LogP | 1.0105 |
| Topological Polar Surface Area | 104.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.00772 |
| Heavy Atoms | 18 |
| Complexity | 454.77615 |
Chemical Identifiers
| CAS Number | 468092-26-4 |
|---|---|
| SMILES | C1C(C(OS(=O)O1)C2=CC=C(C=C2)[N+](=O)[O-])N.Cl |
Product Overview
Cambridge id 5528394 (CAS 468092-26-4), with molecular formula C9H11ClN2O5S and molecular weight 294.01 g/mol. IUPAC: 4-(4-nitrophenyl)-2-oxo-1,3,2-dioxathian-5-amine;hydrochloride.
Chemical Property Profile of Cambridge id 5528394
Property Insights of Cambridge id 5528394
The XLogP value of 1.0105 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cambridge id 5528394. The TPSA of 104.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 5528394. Following Lipinski's Rule of Five, Cambridge id 5528394 has 1 hydrogen bond donor(s) and 6 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 Cambridge id 5528394?
The CAS number of Cambridge id 5528394 is 468092-26-4.
What is the molecular formula of Cambridge id 5528394?
The molecular formula of Cambridge id 5528394 is C9H11ClN2O5S.
What is the molecular weight of Cambridge id 5528394?
The molecular weight of Cambridge id 5528394 is 294.01 g/mol.
Where can I buy Cambridge id 5528394?
You can request a quote for Cambridge id 5528394 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 5528394?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 5528394 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.