Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val
TL;DR: Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val (CAS 176589-08-5) is a chemical compound with molecular formula C27H33N3O7 and molecular weight 511.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-[[2-[[2-[(2R,3R)-3-[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]oxiran-2-yl]acetyl]amino]acetyl]amino]butanoic acid
Also Known As: Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val, Cbz-Phe- .psi.[(R,R)-trans-epoxide]Gly-Val, L-Valine, N-(N-((3-(2-phenyl-1-(((phenylmethoxy)carbonyl)amino)ethyl)oxiranyl)acetyl)glycyl)-, (2R-(2alpha,3beta(S*)))-, (2S)-2-[[2-[[2-[(2R,3R)-3-[(1S)-1-(benzyloxycarbonylamino)-2-phenyl-ethyl]oxiran-2-yl]acetyl]amino]acetyl]amino]-3-methyl-butanoic acid, (2S)-3-methyl-2-[[2-[[2-[(2R,3R)-3-[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]oxiran-2-yl]acetyl]amino]acetyl]amino]butanoic acid
| Molecular Formula | C27H33N3O7 |
|---|---|
| Molecular Weight | 511.23 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 511.23184 |
| Heavy Atoms | 37 |
| Complexity | 778.0 |
Chemical Identifiers
| CAS Number | 176589-08-5 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)CNC(=O)C[C@@H]1[C@H](O1)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 |
| InChIKey | HWQQUDCAYYKRLO-PEARBKPGSA-N |
Product Overview
Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val (CAS 176589-08-5), with molecular formula C27H33N3O7 and molecular weight 511.23 g/mol. IUPAC: (2S)-3-methyl-2-[[2-[[2-[(2R,3R)-3-[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]oxiran-2-yl]acetyl]amino]acetyl]amino]butanoic acid.
Chemical Property Profile of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val
Property Insights of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val. The TPSA of 146.0 Ų indicates high polarity, suggesting Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val?
The CAS number of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val is 176589-08-5.
What is the molecular formula of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val?
The molecular formula of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val is C27H33N3O7.
What is the molecular weight of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val?
The molecular weight of Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val is 511.23 g/mol.
Where can I buy Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val?
You can request a quote for Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val?
Yes, KEHONG BIO provides custom synthesis services for Cbz-Phe-psi((R,R)-trans-epoxide)Gly-Val and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.