tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate
TL;DR: tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate (CAS 7521-94-0) is a chemical compound with molecular formula C58H62N6O9S2 and molecular weight 1050.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-[[3-benzhydrylsulfanyl-2-[[2-[[2-[[2-[[2-(phenylmethoxycarbonylamino)-3-tritylsulfanylpropanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]propanoyl]amino]acetate
Also Known As: tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate, tert-butyl 2-[[3-benzhydrylsulfanyl-2-[[2-[[2-[[2-[[2-(phenylmethoxycarbonylamino)-3-tritylsulfanylpropanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]propanoyl]amino]acetate
| Molecular Formula | C58H62N6O9S2 |
|---|---|
| Molecular Weight | 1050.40 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 261.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 28 |
| Exact Mass | 1050.402 |
| Heavy Atoms | 75 |
| Complexity | 1730.0 |
Chemical Identifiers
| CAS Number | 7521-94-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)CNC(=O)C(CSC(C1=CC=CC=C1)C2=CC=CC=C2)NC(=O)CNC(=O)CNC(=O)CNC(=O)C(CSC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)NC(=O)OCC6=CC=CC=C6 |
| InChIKey | SDTUFAYIKURKOX-UHFFFAOYSA-N |
Product Overview
tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate (CAS 7521-94-0), with molecular formula C58H62N6O9S2 and molecular weight 1050.40 g/mol. IUPAC: tert-butyl 2-[[3-benzhydrylsulfanyl-2-[[2-[[2-[[2-[[2-(phenylmethoxycarbonylamino)-3-tritylsulfanylpropanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]propanoyl]amino]acetate.
Chemical Property Profile of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate
Property Insights of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate
The XLogP value of 8.3 indicates that tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 261.0 Ų indicates high polarity, suggesting tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate?
The CAS number of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate is 7521-94-0.
What is the molecular formula of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate?
The molecular formula of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate is C58H62N6O9S2.
What is the molecular weight of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate?
The molecular weight of tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate is 1050.40 g/mol.
Where can I buy tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate?
You can request a quote for tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl N-[(benzyloxy)carbonyl]-S-(triphenylmethyl)cysteinylglycylglycylglycyl-S-(diphenylmethyl)cysteinylglycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.