RefChem:350680
TL;DR: RefChem:350680 (CAS 96717-71-4) is a chemical compound with molecular formula C20H33N5O5 and molecular weight 423.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-5-amino-2-[[(2S)-4-(4-aminocyclohexa-2,5-dien-1-yl)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]butanoyl]amino]-5-oxopentanoic acid
Also Known As: Valylamiclenomycylglutamine, L-Glutamine, 4-(4-amino-2,5-cyclohexadien-1-yl)-L-2-aminobutanoyl-L-valyl-, trans-, trans-4-(4-Amino-2,5-cyclohexadien-1-yl)-L-2-aminobutanoyl-L-valyl-L-glutamine, L-Glutamine, L-valyl-gamma-(4-amino-2,5-cyclohexadien-1-yl)-L-alpha-aminobutyryl-, trans-, L-Val-4-(4alpha-Amino-2,5-cyclohexadien-1beta-yl)-L-Abu-L-Gln-OH
| Molecular Formula | C20H33N5O5 |
|---|---|
| Molecular Weight | 423.25 g/mol |
| LogP | -0.8609 |
| Topological Polar Surface Area | 190.63 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 423.24817 |
| Heavy Atoms | 30 |
| Complexity | 677.07465 |
Chemical Identifiers
| CAS Number | 96717-71-4 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)N[C@@H](CCC1C=CC(C=C1)N)C(=O)N[C@@H](CCC(=O)N)C(=O)O)N |
Product Overview
RefChem:350680 (CAS 96717-71-4), with molecular formula C20H33N5O5 and molecular weight 423.25 g/mol. IUPAC: (2S)-5-amino-2-[[(2S)-4-(4-aminocyclohexa-2,5-dien-1-yl)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]butanoyl]amino]-5-oxopentanoic acid.
Chemical Property Profile of RefChem:350680
Property Insights of RefChem:350680
The XLogP value of -0.8609 indicates that RefChem:350680 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 190.63 Ų indicates high polarity, suggesting RefChem:350680 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:350680 has 6 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 RefChem:350680?
The CAS number of RefChem:350680 is 96717-71-4.
What is the molecular formula of RefChem:350680?
The molecular formula of RefChem:350680 is C20H33N5O5.
What is the molecular weight of RefChem:350680?
The molecular weight of RefChem:350680 is 423.25 g/mol.
Where can I buy RefChem:350680?
You can request a quote for RefChem:350680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:350680?
Yes, KEHONG BIO provides custom synthesis services for RefChem:350680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.