![L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester structure](/static/products/137/137328-41-7.png)
L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester
TL;DR: L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester (CAS 137328-41-7) is a chemical compound with molecular formula C36H65N7O9 and molecular weight 739.48 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-[(3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-5-methylhexyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoate
Also Known As: L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester, methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methyl-pentanoyl]amino]-4-amino-4-oxo-butanoyl]amino]-2-hydroxy-5-methyl-hexyl]pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butanoate, methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-5-methylhexyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoate
| Molecular Formula | C36H65N7O9 |
|---|---|
| Molecular Weight | 739.48 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 238.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 23 |
| Exact Mass | 739.4844 |
| Heavy Atoms | 52 |
| Complexity | 1230.0 |
Chemical Identifiers
| CAS Number | 137328-41-7 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)OC)NC(=O)[C@@H]1CCCN1CC([C@H](CC(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)C)O |
| InChIKey | AZFPWNIFAYCRMG-AUSHBMHSSA-N |
Product Overview
L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester (CAS 137328-41-7), with molecular formula C36H65N7O9 and molecular weight 739.48 g/mol. IUPAC: methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-5-methylhexyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoate.
Chemical Property Profile of L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester
Property Insights of L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester. The TPSA of 238.0 Ų indicates high polarity, suggesting L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester has 7 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 L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester?
The CAS number of L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester is 137328-41-7.
What is the molecular formula of L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester?
The molecular formula of L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester is C36H65N7O9.
What is the molecular weight of L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester?
The molecular weight of L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester is 739.48 g/mol.
Where can I buy L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester?
You can request a quote for L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for L-Valine, N-[N-[1-[3-[[N2-(N-acetyl-L-leucyl)-L-asparaginyl]amino]-2-hydroxy-5-methylhexyl]-L-prolyl]-L-isoleucyl]-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.