FR 66973
TL;DR: FR 66973 (CAS 114580-45-9) is a chemical compound with molecular formula C20H21N3O9 and molecular weight 447.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[11-acetyl-9-acetyloxy-8-(carbamoyloxymethyl)-4-formyl-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-6-yl] acetate
Also Known As: FR 66973, FK973, FK 973, 3,9-Epoxy-3H-azirino(2,3-c)(1)benzazocine-5-carboxaldehyde, 1-acetyl-7,9-bis(acetyloxy)-8-(((aminocarbonyl)oxy)methyl)-1,1a,2,8,9,9a-hexahydro-, 11-Acetyl-4-formyl-8-carbamoyloxymethyl-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12 ]tetradeca-2,4,6-trien-6,9-diyl diacetate
| Molecular Formula | C20H21N3O9 |
|---|---|
| Molecular Weight | 447.13 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 447.12778 |
| Heavy Atoms | 32 |
| Complexity | 850.0 |
Chemical Identifiers
| CAS Number | 114580-45-9 |
|---|---|
| SMILES | CC(=O)N1C2C1C3(C(C4=C(C=C(C=C4OC(=O)C)C=O)N(C2)O3)COC(=O)N)OC(=O)C |
| InChIKey | FBXPCVIKIBWXAE-UHFFFAOYSA-N |
Product Overview
FR 66973 (CAS 114580-45-9), with molecular formula C20H21N3O9 and molecular weight 447.13 g/mol. IUPAC: [11-acetyl-9-acetyloxy-8-(carbamoyloxymethyl)-4-formyl-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-6-yl] acetate.
Chemical Property Profile of FR 66973
Property Insights of FR 66973
The XLogP value of -0.5 indicates that FR 66973 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting FR 66973 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, FR 66973 has 1 hydrogen bond donor(s) and 10 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 FR 66973?
The CAS number of FR 66973 is 114580-45-9.
What is the molecular formula of FR 66973?
The molecular formula of FR 66973 is C20H21N3O9.
What is the molecular weight of FR 66973?
The molecular weight of FR 66973 is 447.13 g/mol.
Where can I buy FR 66973?
You can request a quote for FR 66973 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for FR 66973?
Yes, KEHONG BIO provides custom synthesis services for FR 66973 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.