Bis(Cbz-Val-Phe)phosphinate isostere
TL;DR: Bis(Cbz-Val-Phe)phosphinate isostere (CAS 146063-30-1) is a chemical compound with molecular formula C43H53N4O9P and molecular weight 800.35504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-hydroxy-2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenylpropyl]-[1-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-phenylethyl]phosphinic acid
Also Known As: Bis(Cbz-Val-Phe)phosphinate isostere, 2,5,10,13-Tetraaza-7-phosphatetradecanedioic acid, 7,8-dihydroxy-3,12-bis(1-methylethyl)-4,11-dioxo-6,9-bis(phenylmethyl)-, bis(phenylmethyl) ester, 7-oxide, [1-hydroxy-2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenylpropyl]-[1-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-phenylethyl]phosphinic acid
Technical Specifications
| Molecular Formula | C43H53N4O9P |
| Molecular Weight | 800.35504 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 192.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 21 |
| Exact Mass | 800.35504 Da |
| Heavy Atoms | 57 |
| Complexity | 1290.0 |
| SMILES | CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(O)P(=O)(C(CC2=CC=CC=C2)NC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3)O)NC(=O)OCC4=CC=CC=C4 |
| InChIKey | GETYISFOACURQQ-UHFFFAOYSA-N |
Chemical Property Profile of Bis(Cbz-Val-Phe)phosphinate isostere
Property Insights of Bis(Cbz-Val-Phe)phosphinate isostere
The XLogP value of 6.4 indicates that Bis(Cbz-Val-Phe)phosphinate isostere is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 192.0 Ų indicates high polarity, suggesting Bis(Cbz-Val-Phe)phosphinate isostere may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis(Cbz-Val-Phe)phosphinate isostere has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bis(Cbz-Val-Phe)phosphinate isostere?
The CAS number of Bis(Cbz-Val-Phe)phosphinate isostere is 146063-30-1.
What is the molecular formula of Bis(Cbz-Val-Phe)phosphinate isostere?
The molecular formula of Bis(Cbz-Val-Phe)phosphinate isostere is C43H53N4O9P.
What is the molecular weight of Bis(Cbz-Val-Phe)phosphinate isostere?
The molecular weight of Bis(Cbz-Val-Phe)phosphinate isostere is 800.35504 g/mol.
Where can I buy Bis(Cbz-Val-Phe)phosphinate isostere?
You can request a quote for Bis(Cbz-Val-Phe)phosphinate isostere directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bis(Cbz-Val-Phe)phosphinate isostere?
Yes, CoreyChem provides custom synthesis services for Bis(Cbz-Val-Phe)phosphinate isostere and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.