Naphthol AS-BI N-acetyl-beta-D-glucosaminide
TL;DR: Naphthol AS-BI N-acetyl-beta-D-glucosaminide (CAS 3395-37-7) is a chemical compound with molecular formula C26H27BrN2O8 and molecular weight 574.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-bromo-N-(2-methoxyphenyl)naphthalene-2-carboxamide
Also Known As: Naphthol AS-BI N-acetyl-beta-D-glucosaminide, NAPHTHOL AS-BI N-ACETYL-B-D-GLUCOSAMINIDE, naphthol as-bi-N-acetyl-beta-d-glucosaminide, Naphthol AS-BI N-acetyl-, A-D-glucosaminide
| Molecular Formula | C26H27BrN2O8 |
|---|---|
| Molecular Weight | 574.10 g/mol |
| LogP | 2.1857 |
| Topological Polar Surface Area | 146.58 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 574.0951 |
| Heavy Atoms | 37 |
| Complexity | 1302.8069 |
Chemical Identifiers
| CAS Number | 3395-37-7 |
|---|---|
| SMILES | CC(=O)NC1C(C(C(OC1OC2=C(C=C3C=C(C=CC3=C2)Br)C(=O)NC4=CC=CC=C4OC)CO)O)O |
Product Overview
Naphthol AS-BI N-acetyl-beta-D-glucosaminide (CAS 3395-37-7), with molecular formula C26H27BrN2O8 and molecular weight 574.10 g/mol. IUPAC: 3-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-bromo-N-(2-methoxyphenyl)naphthalene-2-carboxamide.
Chemical Property Profile of Naphthol AS-BI N-acetyl-beta-D-glucosaminide
Property Insights of Naphthol AS-BI N-acetyl-beta-D-glucosaminide
The XLogP value of 2.1857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphthol AS-BI N-acetyl-beta-D-glucosaminide. The TPSA of 146.58 Ų indicates high polarity, suggesting Naphthol AS-BI N-acetyl-beta-D-glucosaminide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Naphthol AS-BI N-acetyl-beta-D-glucosaminide has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Naphthol AS-BI N-acetyl-beta-D-glucosaminide?
The CAS number of Naphthol AS-BI N-acetyl-beta-D-glucosaminide is 3395-37-7.
What is the molecular formula of Naphthol AS-BI N-acetyl-beta-D-glucosaminide?
The molecular formula of Naphthol AS-BI N-acetyl-beta-D-glucosaminide is C26H27BrN2O8.
What is the molecular weight of Naphthol AS-BI N-acetyl-beta-D-glucosaminide?
The molecular weight of Naphthol AS-BI N-acetyl-beta-D-glucosaminide is 574.10 g/mol.
Where can I buy Naphthol AS-BI N-acetyl-beta-D-glucosaminide?
You can request a quote for Naphthol AS-BI N-acetyl-beta-D-glucosaminide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthol AS-BI N-acetyl-beta-D-glucosaminide?
Yes, KEHONG BIO provides custom synthesis services for Naphthol AS-BI N-acetyl-beta-D-glucosaminide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.