n-butanoylglucosamine
TL;DR: n-butanoylglucosamine (CAS 6857-78-9) is a chemical compound with molecular formula C28H23Cl2N3O5 and molecular weight 551.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[4-[[4-chloro-1-(3-chloro-4-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]phenyl]acetyl]amino]benzoate
Also Known As: n-butanoylglucosamine, Ethyl 4-(2-(4-((4-chloro-1-(3-chloro-4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl)amino)phenyl)acetamido)benzoate, ethyl 4-[[2-[4-[[4-chloro-1-(3-chloro-4-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]phenyl]acetyl]amino]benzoate, ETHYL 4-[[2-[4-[[4-CHLORO-1-(3-CHLORO-4-METHYL-PHENYL)-2,5-DIOXO-PYRROL-3-YL]AMINO]PHENYL]ACETYL]AMINO]BENZOATE, Ethyl 4-[2-(4-{[4-chloro-1-(3-chloro-4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}phenyl)acetamido]benzoate
| Molecular Formula | C28H23Cl2N3O5 |
|---|---|
| Molecular Weight | 551.10 g/mol |
| LogP | 5.44202 |
| Topological Polar Surface Area | 104.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 551.1015 |
| Heavy Atoms | 38 |
| Complexity | 1450.3158 |
Chemical Identifiers
| CAS Number | 6857-78-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CC=C(C=C2)NC3=C(C(=O)N(C3=O)C4=CC(=C(C=C4)C)Cl)Cl |
Product Overview
n-butanoylglucosamine (CAS 6857-78-9), with molecular formula C28H23Cl2N3O5 and molecular weight 551.10 g/mol. IUPAC: ethyl 4-[[2-[4-[[4-chloro-1-(3-chloro-4-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]phenyl]acetyl]amino]benzoate.
Chemical Property Profile of n-butanoylglucosamine
Property Insights of n-butanoylglucosamine
The XLogP value of 5.44202 indicates that n-butanoylglucosamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.81 Ų falls within the moderate polarity range, balancing permeability and solubility for n-butanoylglucosamine. Following Lipinski's Rule of Five, n-butanoylglucosamine has 2 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 n-butanoylglucosamine?
The CAS number of n-butanoylglucosamine is 6857-78-9.
What is the molecular formula of n-butanoylglucosamine?
The molecular formula of n-butanoylglucosamine is C28H23Cl2N3O5.
What is the molecular weight of n-butanoylglucosamine?
The molecular weight of n-butanoylglucosamine is 551.10 g/mol.
Where can I buy n-butanoylglucosamine?
You can request a quote for n-butanoylglucosamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-butanoylglucosamine?
Yes, KEHONG BIO provides custom synthesis services for n-butanoylglucosamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.