RefChem:340776
TL;DR: RefChem:340776 (CAS 5346-63-4) is a chemical compound with molecular formula C10H22ClN2O5PS and molecular weight 348.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-ethylamino]ethyl methanesulfonate
Also Known As: 2-[[3-(2-chloroethyl)-2-oxo-1,3,2, N-(5,6-Diethoxy-2-benzimidazolyl)propionamide, Ethanol, 2-((3-(2-chloroethyl)tetrahydro-2H-1,3,2-oxazaphosphorin-2-yl)ethylamino)-, methanesulfonate (ester), P-oxide, 2-{[3-(2-chloroethyl)-2-oxido-1,3,2-oxazaphosphinan-2-yl](ethyl)amino}ethyl methanesulfonate, E5-oxazaphosphinan-2-yl]-ethylamino]ethyl methanesulfonate
| Molecular Formula | C10H22ClN2O5PS |
|---|---|
| Molecular Weight | 348.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 348.06757 |
| Heavy Atoms | 20 |
| Complexity | 441.0 |
Chemical Identifiers
| CAS Number | 5346-63-4 |
|---|---|
| SMILES | CCN(CCOS(=O)(=O)C)P1(=O)N(CCCO1)CCCl |
| InChIKey | LRYUAPNWHCENRR-UHFFFAOYSA-N |
Product Overview
RefChem:340776 (CAS 5346-63-4), with molecular formula C10H22ClN2O5PS and molecular weight 348.07 g/mol. IUPAC: 2-[[3-(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-ethylamino]ethyl methanesulfonate.
Chemical Property Profile of RefChem:340776
Property Insights of RefChem:340776
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:340776. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:340776. Following Lipinski's Rule of Five, RefChem:340776 has 0 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 RefChem:340776?
The CAS number of RefChem:340776 is 5346-63-4.
What is the molecular formula of RefChem:340776?
The molecular formula of RefChem:340776 is C10H22ClN2O5PS.
What is the molecular weight of RefChem:340776?
The molecular weight of RefChem:340776 is 348.07 g/mol.
Where can I buy RefChem:340776?
You can request a quote for RefChem:340776 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:340776?
Yes, KEHONG BIO provides custom synthesis services for RefChem:340776 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.