(5-Bromo-4-chloro-3-indolyl)-A-D-mannose
TL;DR: (5-Bromo-4-chloro-3-indolyl)-A-D-mannose (CAS 125229-64-3) is a chemical compound with molecular formula C14H15BrClNO6 and molecular weight 406.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4S,5S,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: X-Man, X-a-Mannose, X-alpha-D-mannoside, 5-Bromo-4-chloro-3-indolyl alpha-D-mannopyranoside, (5-BROMO-4-CHLORO-3-INDOLYL)-A-D-MANNOSE
| Molecular Formula | C14H15BrClNO6 |
|---|---|
| Molecular Weight | 406.98 g/mol |
| LogP | 0.7625 |
| Topological Polar Surface Area | 115.17 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.97714 |
| Heavy Atoms | 23 |
| Complexity | 707.8775 |
Chemical Identifiers
| CAS Number | 125229-64-3 |
|---|---|
| SMILES | C1=CC(=C(C2=C1NC=C2O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl)Br |
Product Overview
(5-Bromo-4-chloro-3-indolyl)-A-D-mannose (CAS 125229-64-3), with molecular formula C14H15BrClNO6 and molecular weight 406.98 g/mol. IUPAC: (2R,3S,4S,5S,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose
Property Insights of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose
The XLogP value of 0.7625 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Bromo-4-chloro-3-indolyl)-A-D-mannose. The TPSA of 115.17 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Bromo-4-chloro-3-indolyl)-A-D-mannose. Following Lipinski's Rule of Five, (5-Bromo-4-chloro-3-indolyl)-A-D-mannose has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose?
The CAS number of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose is 125229-64-3.
What is the molecular formula of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose?
The molecular formula of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose is C14H15BrClNO6.
What is the molecular weight of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose?
The molecular weight of (5-Bromo-4-chloro-3-indolyl)-A-D-mannose is 406.98 g/mol.
Where can I buy (5-Bromo-4-chloro-3-indolyl)-A-D-mannose?
You can request a quote for (5-Bromo-4-chloro-3-indolyl)-A-D-mannose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Bromo-4-chloro-3-indolyl)-A-D-mannose?
Yes, KEHONG BIO provides custom synthesis services for (5-Bromo-4-chloro-3-indolyl)-A-D-mannose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.