Tritylthioalanine
TL;DR: Tritylthioalanine (CAS 2781-10-4) is a chemical compound with molecular formula C22H21NO2S and molecular weight 363.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-tritylsulfanylpropanoic acid
Also Known As: S-Trityl-L-cysteine, Tritylcysteine, H-Cys(Trt)-OH, h-d-cys(trt)-oh, S-Tritylcysteine
| Molecular Formula | C22H21NO2S |
|---|---|
| Molecular Weight | 363.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 363.1293 |
| Heavy Atoms | 26 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 2781-10-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC(C(=O)O)N |
| InChIKey | DLMYFMLKORXJPO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tritylthioalanine (CAS 2781-10-4), with molecular formula C22H21NO2S and molecular weight 363.13 g/mol. IUPAC: 2-amino-3-tritylsulfanylpropanoic acid.
Chemical Property Profile of Tritylthioalanine
Property Insights of Tritylthioalanine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tritylthioalanine. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Tritylthioalanine. Following Lipinski's Rule of Five, Tritylthioalanine has 2 hydrogen bond donor(s) and 4 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 Tritylthioalanine?
The CAS number of Tritylthioalanine is 2781-10-4.
What is the molecular formula of Tritylthioalanine?
The molecular formula of Tritylthioalanine is C22H21NO2S.
What is the molecular weight of Tritylthioalanine?
The molecular weight of Tritylthioalanine is 363.13 g/mol.
Where can I buy Tritylthioalanine?
You can request a quote for Tritylthioalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tritylthioalanine?
Yes, KEHONG BIO provides custom synthesis services for Tritylthioalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.