Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester
TL;DR: Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester (CAS 112317-45-0) is a chemical compound with molecular formula C38H52N8O8 and molecular weight 748.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[[(2S)-2-[[(3S,4S)-4-[[(2S)-2-[[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxy-6-methylheptanoyl]amino]propanoyl]amino]-3-phenylpropanoate
Also Known As: Hexapeptide 4, NH2-Phe-gly-his-sta-ala-phe-ome, H2N-Phe-Gly-His-(S,S)-Sta-Ala-Phe-OMe, Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester, methyl (2S)-2-[[(2S)-2-[[(3S,4S)-4-[[(2S)-2-[[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxy-6-methylheptanoyl]amino]propanoyl]amino]-3-phenylpropanoate
| Molecular Formula | C38H52N8O8 |
|---|---|
| Molecular Weight | 748.39 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 247.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 22 |
| Exact Mass | 748.3908 |
| Heavy Atoms | 54 |
| Complexity | 1230.0 |
Chemical Identifiers
| CAS Number | 112317-45-0 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](CC2=CN=CN2)NC(=O)CNC(=O)[C@H](CC3=CC=CC=C3)N)O |
| InChIKey | OHFBCDFWQFKELV-KNIQQNQGSA-N |
Product Overview
Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester (CAS 112317-45-0), with molecular formula C38H52N8O8 and molecular weight 748.39 g/mol. IUPAC: methyl (2S)-2-[[(2S)-2-[[(3S,4S)-4-[[(2S)-2-[[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxy-6-methylheptanoyl]amino]propanoyl]amino]-3-phenylpropanoate.
Chemical Property Profile of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester
Property Insights of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester. The TPSA of 247.0 Ų indicates high polarity, suggesting Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester?
The CAS number of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester is 112317-45-0.
What is the molecular formula of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester?
The molecular formula of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester is C38H52N8O8.
What is the molecular weight of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester?
The molecular weight of Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester is 748.39 g/mol.
Where can I buy Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester?
You can request a quote for Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.