7-Bromo-fmn
TL;DR: 7-Bromo-fmn (CAS 6639-68-5) is a chemical compound with molecular formula C16H18BrN4O9P and molecular weight 520.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(7-bromo-8-methyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate
Also Known As: 7-Bromo fmn, 7-Bromo-fmn, KST-1B7155, Riboflavin 5'-(dihydrogen phosphate), 7-bromo-7-demethyl-, [5-(7-bromo-8-methyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate
| Molecular Formula | C16H18BrN4O9P |
|---|---|
| Molecular Weight | 520.00 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 202.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 519.99945 |
| Heavy Atoms | 31 |
| Complexity | 849.0 |
Chemical Identifiers
| CAS Number | 6639-68-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1Br)N=C3C(=O)NC(=O)N=C3N2CC(C(C(COP(=O)(O)O)O)O)O |
| InChIKey | GLOVWERIXUQLIG-UHFFFAOYSA-N |
Product Overview
7-Bromo-fmn (CAS 6639-68-5), with molecular formula C16H18BrN4O9P and molecular weight 520.00 g/mol. IUPAC: [5-(7-bromo-8-methyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate.
Chemical Property Profile of 7-Bromo-fmn
Property Insights of 7-Bromo-fmn
The XLogP value of -2.2 indicates that 7-Bromo-fmn is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 202.0 Ų indicates high polarity, suggesting 7-Bromo-fmn may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-Bromo-fmn has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-Bromo-fmn?
The CAS number of 7-Bromo-fmn is 6639-68-5.
What is the molecular formula of 7-Bromo-fmn?
The molecular formula of 7-Bromo-fmn is C16H18BrN4O9P.
What is the molecular weight of 7-Bromo-fmn?
The molecular weight of 7-Bromo-fmn is 520.00 g/mol.
Where can I buy 7-Bromo-fmn?
You can request a quote for 7-Bromo-fmn directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Bromo-fmn?
Yes, KEHONG BIO provides custom synthesis services for 7-Bromo-fmn and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.