RefChem:350678
TL;DR: RefChem:350678 (CAS 96717-70-3) is a chemical compound with molecular formula C21H35N5O5 and molecular weight 437.26 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)-2-amino-3-methylpentanoyl]amino]butanoyl]amino]-5-oxopentanoic acid
Also Known As: L-Glutamine, 4-(4-amino-2,5-cyclohexadien-1-yl)-L-2-aminobutanoyl-L-isoleucyl-, trans-, L-Glutamine, L-isoleucyl-gamma-(4-amino-2,5-cyclohexadien-1-yl)-L-alpha-aminobutyryl-, trans-, trans-4-(4-Amino-2,5-cyclohexadien-1-yl)-L-2-aminobutanoyl-L-isoleucyl-L-glutamine, N~2~-[(2S)-4-(4-Aminocyclohexa-2,5-dien-1-yl)-2-(L-isoleucylamino)butanoyl]-L-glutamine, (2S)-5-amino-2-[[(2S)-4-(4-aminocyclohexa-2,5-dien-1-yl)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]butanoyl]amino]-5-oxopentanoic acid
| Molecular Formula | C21H35N5O5 |
|---|---|
| Molecular Weight | 437.26 g/mol |
| LogP | -0.4708 |
| Topological Polar Surface Area | 190.63 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 437.26382 |
| Heavy Atoms | 31 |
| Complexity | 694.27405 |
Chemical Identifiers
| CAS Number | 96717-70-3 |
|---|---|
| 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)N |
Product Overview
RefChem:350678 (CAS 96717-70-3), with molecular formula C21H35N5O5 and molecular weight 437.26 g/mol. IUPAC: (2S)-5-amino-2-[[(2S)-4-(4-aminocyclohexa-2,5-dien-1-yl)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]butanoyl]amino]-5-oxopentanoic acid.
Chemical Property Profile of RefChem:350678
Property Insights of RefChem:350678
The XLogP value of -0.4708 indicates that RefChem:350678 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:350678 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:350678 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:350678?
The CAS number of RefChem:350678 is 96717-70-3.
What is the molecular formula of RefChem:350678?
The molecular formula of RefChem:350678 is C21H35N5O5.
What is the molecular weight of RefChem:350678?
The molecular weight of RefChem:350678 is 437.26 g/mol.
Where can I buy RefChem:350678?
You can request a quote for RefChem:350678 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:350678?
Yes, KEHONG BIO provides custom synthesis services for RefChem:350678 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.