D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr
TL;DR: D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr (CAS 82131-82-6) is a chemical compound with molecular formula C52H74N12O9 and molecular weight 1010.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-[[2-[[2-[[2-[[2-[[1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Also Known As: H 77, D-HIS-PRO-PHE-HIS-LEU-PSI-(CH2NH)-*LEU-V AL-TYR, ((S)-2-((S)-2-((S)-2-((S)-1-(D-histidyl)pyrrolidine-2-carboxamido)-3-phenylpropanamido)-3-(1H-imidazol-4-yl)propanamido)-4-methylpentyl)-L-leucyl-L-valyl-L-tyrosine, 2-[[2-[[2-[[2-[[2-[[2-[[1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
| Molecular Formula | C52H74N12O9 |
|---|---|
| Molecular Weight | 1010.57 g/mol |
| LogP | 1.6423 |
| Topological Polar Surface Area | 318.75 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 28 |
| Exact Mass | 1010.5702 |
| Heavy Atoms | 73 |
| Complexity | 2398.1184 |
Chemical Identifiers
| CAS Number | 82131-82-6 |
|---|---|
| SMILES | CC(C)CC(CNC(CC(C)C)C(=O)NC(C(C)C)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O)NC(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4CCCN4C(=O)C(CC5=CN=CN5)N |
Product Overview
D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr (CAS 82131-82-6), with molecular formula C52H74N12O9 and molecular weight 1010.57 g/mol. IUPAC: 2-[[2-[[2-[[2-[[2-[[2-[[1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid.
Chemical Property Profile of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr
Property Insights of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr
The XLogP value of 1.6423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr. The TPSA of 318.75 Ų indicates high polarity, suggesting D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr has 11 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr?
The CAS number of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr is 82131-82-6.
What is the molecular formula of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr?
The molecular formula of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr is C52H74N12O9.
What is the molecular weight of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr?
The molecular weight of D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr is 1010.57 g/mol.
Where can I buy D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr?
You can request a quote for D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr?
Yes, KEHONG BIO provides custom synthesis services for D-His-pro-phe-his-leu-psi-(CH2NH)-*leu-V AL-tyr and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.