Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-
TL;DR: Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- (CAS 147402-73-1) is a chemical compound with molecular formula C9H14N2O and molecular weight 166.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-[(2R)-1-methylpyrrolidin-2-yl]-1,2-oxazole
Also Known As: Abt 418, ABT-418, (R)-, (R)-ABT-418, 3-Methyl-5-(1-methyl-2(R)-pyrrolidinyl)isoxazole, (R)-3-Methyl-5-(1-methylpyrrolidin-2-yl)isoxazole
| Molecular Formula | C9H14N2O |
|---|---|
| Molecular Weight | 166.11 g/mol |
| LogP | 1.74972 |
| Topological Polar Surface Area | 29.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.11061 |
| Heavy Atoms | 12 |
| Complexity | 269.2472 |
Chemical Identifiers
| CAS Number | 147402-73-1 |
|---|---|
| SMILES | CC1=NOC(=C1)[C@H]2CCCN2C |
Product Overview
Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- (CAS 147402-73-1), with molecular formula C9H14N2O and molecular weight 166.11 g/mol. IUPAC: 3-methyl-5-[(2R)-1-methylpyrrolidin-2-yl]-1,2-oxazole.
Chemical Property Profile of Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-
Property Insights of Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-
The XLogP value of 1.74972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-. With a topological polar surface area (TPSA) of 29.27 Ų, Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- has 0 hydrogen bond donor(s) and 3 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 Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-?
The CAS number of Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- is 147402-73-1.
What is the molecular formula of Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-?
The molecular formula of Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- is C9H14N2O.
What is the molecular weight of Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-?
The molecular weight of Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- is 166.11 g/mol.
Where can I buy Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-?
You can request a quote for Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Isoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.