(2S,3R)-2-Methyl-3-morpholinecarboxylic acid
TL;DR: (2S,3R)-2-Methyl-3-morpholinecarboxylic acid (CAS 126848-06-4) is a chemical compound with molecular formula C25H25N7O and molecular weight 439.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-5-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridine
Also Known As: (2S,3R)-2-Methyl-3-morpholinecarboxylic acid, 2-(2-(4-Methoxyphenyl)-1H-B enzimidazol-5-yl)-5-(4-methyl-1-piperazinyl)-1H-imidazo(4,5-b)pyridine, 2-(2-(4-Methoxyphenyl)-1H-benzimidazol-5-yl)-5-(4-methyl-1-piperazinyl)-1H-imidazo(4,5-b)pyridine, 2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-5-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridine, Pyrido(2,1-b)-1,2,3-triazolo(4,5-f)quinazolin-12(1H)-one, 7-methyl-
| Molecular Formula | C25H25N7O |
|---|---|
| Molecular Weight | 439.21 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 86.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 439.21207 |
| Heavy Atoms | 33 |
| Complexity | 651.0 |
Chemical Identifiers
| CAS Number | 126848-06-4 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=C(C=C2)NC(=N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OC |
| InChIKey | OXVQOQYTGHCJCI-UHFFFAOYSA-N |
Product Overview
(2S,3R)-2-Methyl-3-morpholinecarboxylic acid (CAS 126848-06-4), with molecular formula C25H25N7O and molecular weight 439.21 g/mol. IUPAC: 2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-5-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridine.
Chemical Property Profile of (2S,3R)-2-Methyl-3-morpholinecarboxylic acid
Property Insights of (2S,3R)-2-Methyl-3-morpholinecarboxylic acid
The XLogP value of 3.9 indicates that (2S,3R)-2-Methyl-3-morpholinecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,3R)-2-Methyl-3-morpholinecarboxylic acid. Following Lipinski's Rule of Five, (2S,3R)-2-Methyl-3-morpholinecarboxylic acid has 2 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 (2S,3R)-2-Methyl-3-morpholinecarboxylic acid?
The CAS number of (2S,3R)-2-Methyl-3-morpholinecarboxylic acid is 126848-06-4.
What is the molecular formula of (2S,3R)-2-Methyl-3-morpholinecarboxylic acid?
The molecular formula of (2S,3R)-2-Methyl-3-morpholinecarboxylic acid is C25H25N7O.
What is the molecular weight of (2S,3R)-2-Methyl-3-morpholinecarboxylic acid?
The molecular weight of (2S,3R)-2-Methyl-3-morpholinecarboxylic acid is 439.21 g/mol.
Where can I buy (2S,3R)-2-Methyl-3-morpholinecarboxylic acid?
You can request a quote for (2S,3R)-2-Methyl-3-morpholinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,3R)-2-Methyl-3-morpholinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S,3R)-2-Methyl-3-morpholinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.