5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester
TL;DR: 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester (CAS 111070-40-7) is a chemical compound with molecular formula C33H39BrN6O8S and molecular weight 758.17334 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 5-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentan-2-yl]amino]sulfanylbenzene-1,3-dicarboxylate;hydrobromide
Also Known As: Papaie, Z-Phe-arg-psi(CS)-aie, 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester, dimethyl 5-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentan-2-yl]amino]sulfanylbenzene-1,3-dicarboxylate;hydrobromide, L-Argininamide, N-((phenylmethoxy)carbonyl)-L-phenylalanyl-N-(3,5-bis(methoxycarbonyl)phenyl)thio-, monohydrobromide
Technical Specifications
| Molecular Formula | C33H39BrN6O8S |
| Molecular Weight | 758.17334 g/mol |
| XLogP | 3.0371 |
| Topological Polar Surface Area (TPSA) | 239.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 19 |
| Exact Mass | 758.17334 Da |
| Heavy Atoms | 49 |
| Complexity | 1070.0 |
| SMILES | COC(=O)C1=CC(=CC(=C1)SN[C@@H](CCCN=C(N)N)C(=O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)OC.Br |
| InChIKey | QQCPHRXFCBQYCA-WMXJXTQLSA-N |
Product Description
Applications: 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester (CAS 111070-40-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester (CAS 111070-40-7) has the molecular formula C33H39BrN6O8S and a molecular weight of 758.17 g/mol. It is also known as Papaie and Z-Phe-arg-psi(CS)-aie.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester
Property Insights of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester
The XLogP value of 3.0371 indicates that 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 239.0 Ų indicates high polarity, suggesting 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester?
The CAS number of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester is 111070-40-7.
What is the molecular formula of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester?
The molecular formula of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester is C33H39BrN6O8S.
What is the molecular weight of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester?
The molecular weight of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester is 758.17334 g/mol.
What are the applications of 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester?
5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid...
Where can I buy 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester?
You can request a quote for 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester?
Yes, CoreyChem provides custom synthesis services for 5-(Benzyloxycarbonylphenylalanylarginylthioamido)isophthalic acid dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.