tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester
TL;DR: tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester (CAS 94492-33-8) is a chemical compound with molecular formula C28H37N5O7S and molecular weight 587.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-ethylsulfanylpropanoic acid
Also Known As: Tyr-ala-gly-phe-cys(Et), Tyr-D-Ala-Gly-Phe-Cys(Et), Tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester, L-Tyrosyl-D-alanylglycyl-L-phenylalanyl-S-ethyl-L-cysteine, (2R)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-ethylsulfanylpropanoic acid
| Molecular Formula | C28H37N5O7S |
|---|---|
| Molecular Weight | 587.24 g/mol |
| LogP | -0.0671 |
| Topological Polar Surface Area | 199.95 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 587.2414 |
| Heavy Atoms | 41 |
| Complexity | 1180.1132 |
Chemical Identifiers
| CAS Number | 94492-33-8 |
|---|---|
| SMILES | CCSC[C@@H](C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(C=C2)O)N |
Product Overview
tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester (CAS 94492-33-8), with molecular formula C28H37N5O7S and molecular weight 587.24 g/mol. IUPAC: (2R)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-ethylsulfanylpropanoic acid.
Chemical Property Profile of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester
Property Insights of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester
The XLogP value of -0.0671 indicates that tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 199.95 Ų indicates high polarity, suggesting tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester?
The CAS number of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester is 94492-33-8.
What is the molecular formula of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester?
The molecular formula of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester is C28H37N5O7S.
What is the molecular weight of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester?
The molecular weight of tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester is 587.24 g/mol.
Where can I buy tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester?
You can request a quote for tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for tyrosyl-alanyl-glycyl-phenylalanyl-cysteine S-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.