ethyl n,s-ditritylcysteinyl-s-tritylcysteinate
TL;DR: ethyl n,s-ditritylcysteinyl-s-tritylcysteinate (CAS 36163-70-9) is a chemical compound with molecular formula C65H58N2O3S2 and molecular weight 978.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(tritylamino)-3-tritylsulfanylpropanoyl]amino]-3-tritylsulfanylpropanoate
Also Known As: ethyl n,s-ditritylcysteinyl-s-tritylcysteinate, ethyl 2-[[2-(tritylamino)-3-tritylsulfanylpropanoyl]amino]-3-tritylsulfanylpropanoate
| Molecular Formula | C65H58N2O3S2 |
|---|---|
| Molecular Weight | 978.39 g/mol |
| LogP | 14.8 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 22 |
| Exact Mass | 978.3889 |
| Heavy Atoms | 72 |
| Complexity | 1430.0 |
Chemical Identifiers
| CAS Number | 36163-70-9 |
|---|---|
| SMILES | CCOC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C(CSC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)NC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9 |
| InChIKey | BZZMQHJAORLLQS-UHFFFAOYSA-N |
Product Overview
ethyl n,s-ditritylcysteinyl-s-tritylcysteinate (CAS 36163-70-9), with molecular formula C65H58N2O3S2 and molecular weight 978.39 g/mol. IUPAC: ethyl 2-[[2-(tritylamino)-3-tritylsulfanylpropanoyl]amino]-3-tritylsulfanylpropanoate.
Chemical Property Profile of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate
Property Insights of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate
The XLogP value of 14.8 indicates that ethyl n,s-ditritylcysteinyl-s-tritylcysteinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl n,s-ditritylcysteinyl-s-tritylcysteinate. Following Lipinski's Rule of Five, ethyl n,s-ditritylcysteinyl-s-tritylcysteinate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate?
The CAS number of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate is 36163-70-9.
What is the molecular formula of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate?
The molecular formula of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate is C65H58N2O3S2.
What is the molecular weight of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate?
The molecular weight of ethyl n,s-ditritylcysteinyl-s-tritylcysteinate is 978.39 g/mol.
Where can I buy ethyl n,s-ditritylcysteinyl-s-tritylcysteinate?
You can request a quote for ethyl n,s-ditritylcysteinyl-s-tritylcysteinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl n,s-ditritylcysteinyl-s-tritylcysteinate?
Yes, KEHONG BIO provides custom synthesis services for ethyl n,s-ditritylcysteinyl-s-tritylcysteinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.