(2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate
TL;DR: (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate (CAS 135681-66-2) is a chemical compound with molecular formula C24H25NO2S and molecular weight 391.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate
Also Known As: (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate
| Molecular Formula | C24H25NO2S |
|---|---|
| Molecular Weight | 391.16 g/mol |
| LogP | 2.8507 |
| Topological Polar Surface Area | 67.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.1606 |
| Heavy Atoms | 28 |
| Complexity | 814.44574 |
Chemical Identifiers
| CAS Number | 135681-66-2 |
|---|---|
| SMILES | CC(C)([C@@H](C(=O)[O-])[NH3+])SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
(2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate (CAS 135681-66-2), with molecular formula C24H25NO2S and molecular weight 391.16 g/mol. IUPAC: (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate.
Chemical Property Profile of (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate
Property Insights of (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate
The XLogP value of 2.8507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate. The TPSA of 67.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate. Following Lipinski's Rule of Five, (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate has 1 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 (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate?
The CAS number of (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate is 135681-66-2.
What is the molecular formula of (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate?
The molecular formula of (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate is C24H25NO2S.
What is the molecular weight of (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate?
The molecular weight of (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate is 391.16 g/mol.
Where can I buy (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate?
You can request a quote for (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for (2R)-2-azaniumyl-3-methyl-3-tritylsulfanylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.