5-bromo-6-chloro-1H-indol-3-yl phosphate
TL;DR: 5-bromo-6-chloro-1H-indol-3-yl phosphate (CAS 6769-80-8) is a chemical compound with molecular formula C8H4BrClNO4P-2 and molecular weight 322.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-bromo-6-chloro-1H-indol-3-yl) phosphate
Also Known As: 5-bromo-6-chloro-1H-indol-3-yl phosphate, 5-Bromo-6-chloro-3-indolyl phosphate p-toluidine salt, (5-bromo-6-chloro-1H-indol-3-yl)oxy-dioxido-oxo-phosphorane
| Molecular Formula | C8H4BrClNO4P-2 |
|---|---|
| Molecular Weight | 322.87 g/mol |
| LogP | 1.7913 |
| Topological Polar Surface Area | 88.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.87497 |
| Heavy Atoms | 16 |
| Complexity | 592.981 |
Chemical Identifiers
| CAS Number | 6769-80-8 |
|---|---|
| SMILES | C1=C2C(=CC(=C1Br)Cl)NC=C2OP(=O)([O-])[O-] |
Product Overview
5-bromo-6-chloro-1H-indol-3-yl phosphate (CAS 6769-80-8), with molecular formula C8H4BrClNO4P-2 and molecular weight 322.87 g/mol. IUPAC: (5-bromo-6-chloro-1H-indol-3-yl) phosphate.
Chemical Property Profile of 5-bromo-6-chloro-1H-indol-3-yl phosphate
Property Insights of 5-bromo-6-chloro-1H-indol-3-yl phosphate
The XLogP value of 1.7913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-6-chloro-1H-indol-3-yl phosphate. The TPSA of 88.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-6-chloro-1H-indol-3-yl phosphate. Following Lipinski's Rule of Five, 5-bromo-6-chloro-1H-indol-3-yl phosphate has 1 hydrogen bond donor(s) and 4 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-6-chloro-1H-indol-3-yl phosphate?
The CAS number of 5-bromo-6-chloro-1H-indol-3-yl phosphate is 6769-80-8.
What is the molecular formula of 5-bromo-6-chloro-1H-indol-3-yl phosphate?
The molecular formula of 5-bromo-6-chloro-1H-indol-3-yl phosphate is C8H4BrClNO4P-2.
What is the molecular weight of 5-bromo-6-chloro-1H-indol-3-yl phosphate?
The molecular weight of 5-bromo-6-chloro-1H-indol-3-yl phosphate is 322.87 g/mol.
Where can I buy 5-bromo-6-chloro-1H-indol-3-yl phosphate?
You can request a quote for 5-bromo-6-chloro-1H-indol-3-yl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-6-chloro-1H-indol-3-yl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-6-chloro-1H-indol-3-yl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.