RefChem:350679
TL;DR: RefChem:350679 (CAS 96717-72-5) is a chemical compound with molecular formula C22H37N5O5 and molecular weight 451.28 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,3S)-3-methyl-2-(methylamino)pentanoyl]amino]butanoyl]amino]-5-oxopentanoic acid
Also Known As: L-Glutamine, 4-(4-amino-2,5-cyclohexadien-1-yl)-L-2-aminobutanoyl-L-isoleucyl-N-methyl-, trans-, (2S)-5-amino-2-[[(2S)-4-(4-aminocyclohexa-2,5-dien-1-yl)-2-[[(2S,3S)-3-methyl-2-(methylamino)pentanoyl]amino]butanoyl]amino]-5-oxopentanoic acid, N~2~-{(2S)-4-(4-Aminocyclohexa-2,5-dien-1-yl)-2-[(N-methyl-L-isoleucyl)amino]butanoyl}-L-glutamine, BRN 5660392, RefChem:350679
| Molecular Formula | C22H37N5O5 |
|---|---|
| Molecular Weight | 451.28 g/mol |
| LogP | -0.2101 |
| Topological Polar Surface Area | 176.64 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 451.27948 |
| Heavy Atoms | 32 |
| Complexity | 709.5001 |
Chemical Identifiers
| CAS Number | 96717-72-5 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC1C=CC(C=C1)N)C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC |
Product Overview
RefChem:350679 (CAS 96717-72-5), with molecular formula C22H37N5O5 and molecular weight 451.28 g/mol. IUPAC: (2S)-5-amino-2-[[(2S)-4-(4-aminocyclohexa-2,5-dien-1-yl)-2-[[(2S,3S)-3-methyl-2-(methylamino)pentanoyl]amino]butanoyl]amino]-5-oxopentanoic acid.
Chemical Property Profile of RefChem:350679
Property Insights of RefChem:350679
The XLogP value of -0.2101 indicates that RefChem:350679 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 176.64 Ų indicates high polarity, suggesting RefChem:350679 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:350679 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:350679?
The CAS number of RefChem:350679 is 96717-72-5.
What is the molecular formula of RefChem:350679?
The molecular formula of RefChem:350679 is C22H37N5O5.
What is the molecular weight of RefChem:350679?
The molecular weight of RefChem:350679 is 451.28 g/mol.
Where can I buy RefChem:350679?
You can request a quote for RefChem:350679 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:350679?
Yes, KEHONG BIO provides custom synthesis services for RefChem:350679 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.