Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3
TL;DR: Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 (CAS 126380-02-7) is a chemical compound with molecular formula C34H48N4O8 and molecular weight 640.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[[(2S)-2-[[(4S,5S)-4-hydroxy-6-phenyl-5-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoate
Also Known As: Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3, Cbz-Ala-Phe.psi.[CH(OH)CH2]Gly-Val-Val-OCH3, L-Valine, N-(N-(4-hydroxy-1-oxo-5-((1-oxo-2-(((phenylmethoxy)carbonyl)amino)propyl)amino)-6-phenylhexyl)-L-valyl)-, methyl ester, (4S-(4R*,5R*(R*)))-, L-Valine, N-[N-[4-hydroxy-1-oxo-5-[[1-oxo-2-[[(phenylmethoxy)carbonyl]amino]propyl]amino]-6-phenylhexyl]-L-valyl]-, methyl ester, [4S-[4R*,5R*(R*)]]-, Methyl (2S)-2-[(2S)-2-(5-{(2S)-2-[(phenylmethoxy)carbonylamino]propanoylamino}(4S,5S)-4-hydroxy-6-phenylhexanoylamino)-3-methylbutanoylamino]-3-methylbutanoate
| Molecular Formula | C34H48N4O8 |
|---|---|
| Molecular Weight | 640.35 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 19 |
| Exact Mass | 640.3472 |
| Heavy Atoms | 46 |
| Complexity | 978.0 |
Chemical Identifiers
| CAS Number | 126380-02-7 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](CCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC)O)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | UXNIFTCWMPGHCU-GKORLBRISA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 (CAS 126380-02-7), with molecular formula C34H48N4O8 and molecular weight 640.35 g/mol. IUPAC: methyl (2S)-2-[[(2S)-2-[[(4S,5S)-4-hydroxy-6-phenyl-5-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoate.
Chemical Property Profile of Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3
Property Insights of Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3
The XLogP value of 4.2 indicates that Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 has 5 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 Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3?
The CAS number of Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 is 126380-02-7.
What is the molecular formula of Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3?
The molecular formula of Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 is C34H48N4O8.
What is the molecular weight of Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3?
The molecular weight of Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 is 640.35 g/mol.
Where can I buy Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3?
You can request a quote for Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3?
Yes, KEHONG BIO provides custom synthesis services for Cbz-Ala-Phepsi(CH(OH)CH2)Gly-Val-Val-OCH3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.