Alap-hea-piv
TL;DR: Alap-hea-piv (CAS 127231-42-9) is a chemical compound with molecular formula C42H68N8O11 and molecular weight 860.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2S,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-4-phenylbutyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoate
Also Known As: Alap-hea-piv, 7hvp, JG 365, (S)-JG-365, N-Acetylseryl-leucyl-asparaginyl(phenylalanyl-hydroxyethylamino-prolyl)isoleucyl-valyl methyl ester
| Molecular Formula | C42H68N8O11 |
|---|---|
| Molecular Weight | 860.50 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 288.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 26 |
| Exact Mass | 860.50073 |
| Heavy Atoms | 61 |
| Complexity | 1490.0 |
Chemical Identifiers
| CAS Number | 127231-42-9 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)OC)NC(=O)[C@@H]1CCCN1C[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)C)O |
| InChIKey | MJOXWVYKMFPFPL-FPBYMMTFSA-N |
Product Overview
Alap-hea-piv (CAS 127231-42-9), with molecular formula C42H68N8O11 and molecular weight 860.50 g/mol. IUPAC: methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2S,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-4-phenylbutyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoate.
Chemical Property Profile of Alap-hea-piv
Property Insights of Alap-hea-piv
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alap-hea-piv. The TPSA of 288.0 Ų indicates high polarity, suggesting Alap-hea-piv may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Alap-hea-piv has 9 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 Alap-hea-piv?
The CAS number of Alap-hea-piv is 127231-42-9.
What is the molecular formula of Alap-hea-piv?
The molecular formula of Alap-hea-piv is C42H68N8O11.
What is the molecular weight of Alap-hea-piv?
The molecular weight of Alap-hea-piv is 860.50 g/mol.
Where can I buy Alap-hea-piv?
You can request a quote for Alap-hea-piv directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alap-hea-piv?
Yes, KEHONG BIO provides custom synthesis services for Alap-hea-piv and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.