Mitiglinide calcium
TL;DR: Mitiglinide calcium (CAS 145525-41-3) is a chemical compound with molecular formula C38H48CaN2O6 and molecular weight 668.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium;(2R)-4-[(3aS,7aR)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-2-benzyl-4-oxobutanoate;(2S)-4-[(3aS,7aR)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-2-benzyl-4-oxobutanoate
Also Known As: Mitiglinide calcium
| Molecular Formula | C38H48CaN2O6 |
|---|---|
| Molecular Weight | 668.31 g/mol |
| LogP | 2.89 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 668.31384 |
| Heavy Atoms | 47 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 145525-41-3 |
|---|---|
| SMILES | C1CC[C@H]2CN(C[C@H]2C1)C(=O)C[C@@H](CC3=CC=CC=C3)C(=O)[O-].C1CC[C@H]2CN(C[C@H]2C1)C(=O)C[C@H](CC3=CC=CC=C3)C(=O)[O-].[Ca+2] |
| InChIKey | PMRVFZXOCRHXFE-WXPKPKAASA-L |
Product Overview
Mitiglinide calcium (CAS 145525-41-3), with molecular formula C38H48CaN2O6 and molecular weight 668.31 g/mol. IUPAC: calcium;(2R)-4-[(3aS,7aR)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-2-benzyl-4-oxobutanoate;(2S)-4-[(3aS,7aR)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-2-benzyl-4-oxobutanoate.
Chemical Property Profile of Mitiglinide calcium
Property Insights of Mitiglinide calcium
The XLogP value of 2.89 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mitiglinide calcium. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mitiglinide calcium. Following Lipinski's Rule of Five, Mitiglinide calcium has 0 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 Mitiglinide calcium?
The CAS number of Mitiglinide calcium is 145525-41-3.
What is the molecular formula of Mitiglinide calcium?
The molecular formula of Mitiglinide calcium is C38H48CaN2O6.
What is the molecular weight of Mitiglinide calcium?
The molecular weight of Mitiglinide calcium is 668.31 g/mol.
Where can I buy Mitiglinide calcium?
You can request a quote for Mitiglinide calcium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mitiglinide calcium?
Yes, KEHONG BIO provides custom synthesis services for Mitiglinide calcium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.