(2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol
TL;DR: (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol (CAS 540470-46-0) is a chemical compound with molecular formula C7H17NO5 and molecular weight 195.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentol
Also Known As: meglumine, Fosaprepitant Impurity 43, J1.105.066B, (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentol, (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol
| Molecular Formula | C7H17NO5 |
|---|---|
| Molecular Weight | 195.11 g/mol |
| LogP | -2.8 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 195.11067 |
| Heavy Atoms | 13 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 540470-46-0 |
|---|---|
| SMILES | CNC[C@H]([C@@H]([C@H]([C@H](CO)O)O)O)O |
| InChIKey | MBBZMMPHUWSWHV-BWBBJGPYSA-N |
Product Overview
(2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol (CAS 540470-46-0), with molecular formula C7H17NO5 and molecular weight 195.11 g/mol. IUPAC: (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentol.
Chemical Property Profile of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol
Property Insights of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol
The XLogP value of -2.8 indicates that (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol. Following Lipinski's Rule of Five, (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol?
The CAS number of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol is 540470-46-0.
What is the molecular formula of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol?
The molecular formula of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol is C7H17NO5.
What is the molecular weight of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol?
The molecular weight of (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol is 195.11 g/mol.
Where can I buy (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol?
You can request a quote for (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol?
Yes, KEHONG BIO provides custom synthesis services for (2S,3S,4S,5R)-6-(methylamino)hexane-1,2,3,4,5-pentaol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.