Boc-PPE-Ile-AMBIL
TL;DR: Boc-PPE-Ile-AMBIL (CAS 132565-33-4) is a chemical compound with molecular formula C40H51N5O5 and molecular weight 681.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(E,2S,3S,5R)-5-[[(2S,3S)-1-(1H-benzimidazol-2-ylmethylamino)-3-methyl-1-oxopentan-2-yl]carbamoyl]-3-hydroxy-1,8-diphenyloct-7-en-2-yl]carbamate
Also Known As: Boc-PPE-Ile-AMBIL, L 687908, L-687908, L687,908, L-687,908
| Molecular Formula | C40H51N5O5 |
|---|---|
| Molecular Weight | 681.39 g/mol |
| LogP | 6.3167 |
| Topological Polar Surface Area | 145.44 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 681.38904 |
| Heavy Atoms | 50 |
| Complexity | 1666.3851 |
Chemical Identifiers
| CAS Number | 132565-33-4 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)NCC1=NC2=CC=CC=C2N1)NC(=O)[C@H](C/C=C/C3=CC=CC=C3)C[C@@H]([C@H](CC4=CC=CC=C4)NC(=O)OC(C)(C)C)O |
Product Overview
Boc-PPE-Ile-AMBIL (CAS 132565-33-4), with molecular formula C40H51N5O5 and molecular weight 681.39 g/mol. IUPAC: tert-butyl N-[(E,2S,3S,5R)-5-[[(2S,3S)-1-(1H-benzimidazol-2-ylmethylamino)-3-methyl-1-oxopentan-2-yl]carbamoyl]-3-hydroxy-1,8-diphenyloct-7-en-2-yl]carbamate.
Chemical Property Profile of Boc-PPE-Ile-AMBIL
Property Insights of Boc-PPE-Ile-AMBIL
The XLogP value of 6.3167 indicates that Boc-PPE-Ile-AMBIL is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.44 Ų indicates high polarity, suggesting Boc-PPE-Ile-AMBIL may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Boc-PPE-Ile-AMBIL has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Boc-PPE-Ile-AMBIL?
The CAS number of Boc-PPE-Ile-AMBIL is 132565-33-4.
What is the molecular formula of Boc-PPE-Ile-AMBIL?
The molecular formula of Boc-PPE-Ile-AMBIL is C40H51N5O5.
What is the molecular weight of Boc-PPE-Ile-AMBIL?
The molecular weight of Boc-PPE-Ile-AMBIL is 681.39 g/mol.
Where can I buy Boc-PPE-Ile-AMBIL?
You can request a quote for Boc-PPE-Ile-AMBIL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-PPE-Ile-AMBIL?
Yes, KEHONG BIO provides custom synthesis services for Boc-PPE-Ile-AMBIL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.