N,S-ditritylcysteine
TL;DR: N,S-ditritylcysteine (CAS 27686-50-6) is a chemical compound with molecular formula C41H35NO2S and molecular weight 605.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(tritylamino)-3-tritylsulfanylpropanoic acid
Also Known As: Trt-Cys(Trt)-OH, N,S-ditritylcysteine, 2-(tritylamino)-3-tritylsulfanylpropanoic acid, 2-(tritylamino)-3-tritylsulfanyl-propanoic Acid, 2-(tritylamino)-3-(tritylthio)propanoic acid - N-ethylethanamine (1:1)
| Molecular Formula | C41H35NO2S |
|---|---|
| Molecular Weight | 605.24 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 605.23883 |
| Heavy Atoms | 45 |
| Complexity | 779.0 |
Chemical Identifiers
| CAS Number | 27686-50-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CSC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)O |
| InChIKey | OJBZHLUHWUVJEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,S-ditritylcysteine (CAS 27686-50-6), with molecular formula C41H35NO2S and molecular weight 605.24 g/mol. IUPAC: 2-(tritylamino)-3-tritylsulfanylpropanoic acid.
Chemical Property Profile of N,S-ditritylcysteine
Property Insights of N,S-ditritylcysteine
The XLogP value of 7.1 indicates that N,S-ditritylcysteine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N,S-ditritylcysteine. Following Lipinski's Rule of Five, N,S-ditritylcysteine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,S-ditritylcysteine?
The CAS number of N,S-ditritylcysteine is 27686-50-6.
What is the molecular formula of N,S-ditritylcysteine?
The molecular formula of N,S-ditritylcysteine is C41H35NO2S.
What is the molecular weight of N,S-ditritylcysteine?
The molecular weight of N,S-ditritylcysteine is 605.24 g/mol.
Where can I buy N,S-ditritylcysteine?
You can request a quote for N,S-ditritylcysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,S-ditritylcysteine?
Yes, KEHONG BIO provides custom synthesis services for N,S-ditritylcysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.