![5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] structure](/static/products/817/81785-45-7.png)
5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]
TL;DR: 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] (CAS 81785-45-7) is a chemical compound with molecular formula C15H20Cl2N2O6 and molecular weight 394.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,3aR,6S,6aS)-3-[3-(2-chlorophenoxy)propylamino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate;hydrochloride
Also Known As: 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German], L-Iditol, 1,4:3,6-dianhydro-2-((3-(2-chlorophenoxy)propyl)amino)-2-deoxy-, 5-nitrate, monohydrochloride, 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl, [(3S,3aR,6S,6aS)-3-[3-(2-chlorophenoxy)propylamino]-2,3,3a,5, 5-(3- -5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitratHCl[German]
| Molecular Formula | C15H20Cl2N2O6 |
|---|---|
| Molecular Weight | 394.07 g/mol |
| LogP | 1.8634 |
| Topological Polar Surface Area | 92.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 394.06985 |
| Heavy Atoms | 25 |
| Complexity | 578.7075 |
Chemical Identifiers
| CAS Number | 81785-45-7 |
|---|---|
| SMILES | C1[C@@H]([C@@H]2[C@H](O1)[C@H](CO2)O[N+](=O)[O-])NCCCOC3=CC=CC=C3Cl.Cl |
Product Overview
5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] (CAS 81785-45-7), with molecular formula C15H20Cl2N2O6 and molecular weight 394.07 g/mol. IUPAC: [(3S,3aR,6S,6aS)-3-[3-(2-chlorophenoxy)propylamino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate;hydrochloride.
Chemical Property Profile of 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]
Property Insights of 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]
The XLogP value of 1.8634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]. The TPSA of 92.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]. Following Lipinski's Rule of Five, 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] has 1 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-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]?
The CAS number of 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] is 81785-45-7.
What is the molecular formula of 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]?
The molecular formula of 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] is C15H20Cl2N2O6.
What is the molecular weight of 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]?
The molecular weight of 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] is 394.07 g/mol.
Where can I buy 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]?
You can request a quote for 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-(2-Chlorphenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.