5-Deaza-fmn
TL;DR: 5-Deaza-fmn (CAS 36408-16-9) is a chemical compound with molecular formula C18H22N3O9P and molecular weight 455.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(7,8-dimethyl-2,4-dioxopyrimido[4,5-b]quinolin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate
Also Known As: Deazafmn, 5-Deaza-fmn, 5-Deazariboflavin-5'-phosphate, [5-(7,8-dimethyl-2,4-dioxopyrimido[4,5-b]quinolin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate, 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2h)-yl)-5-o-phosphonopentitol
| Molecular Formula | C18H22N3O9P |
|---|---|
| Molecular Weight | 455.11 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 189.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.10938 |
| Heavy Atoms | 31 |
| Complexity | 841.0 |
Chemical Identifiers
| CAS Number | 36408-16-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=C2)CC(C(C(COP(=O)(O)O)O)O)O |
| InChIKey | LAWFKZVKVIYTAR-UHFFFAOYSA-N |
Product Overview
5-Deaza-fmn (CAS 36408-16-9), with molecular formula C18H22N3O9P and molecular weight 455.11 g/mol. IUPAC: [5-(7,8-dimethyl-2,4-dioxopyrimido[4,5-b]quinolin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate.
Chemical Property Profile of 5-Deaza-fmn
Property Insights of 5-Deaza-fmn
The XLogP value of -2.0 indicates that 5-Deaza-fmn is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 189.0 Ų indicates high polarity, suggesting 5-Deaza-fmn may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-Deaza-fmn has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Deaza-fmn?
The CAS number of 5-Deaza-fmn is 36408-16-9.
What is the molecular formula of 5-Deaza-fmn?
The molecular formula of 5-Deaza-fmn is C18H22N3O9P.
What is the molecular weight of 5-Deaza-fmn?
The molecular weight of 5-Deaza-fmn is 455.11 g/mol.
Where can I buy 5-Deaza-fmn?
You can request a quote for 5-Deaza-fmn directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Deaza-fmn?
Yes, KEHONG BIO provides custom synthesis services for 5-Deaza-fmn and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.