AB00401659-07
TL;DR: AB00401659-07 (CAS 877791-08-7) is a chemical compound with molecular formula C20H15BrN2O7 and molecular weight 474.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxazol-3-yl)-2H-pyrrol-5-one
Also Known As: AB00401659-07, (4E)-5-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione, 2-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxazol-3-yl)-2H-pyrrol-5-one, 5-(3-BROMO-4-HYDROXY-5-METHOXYPHENYL)-4-(FURAN-2-CARBONYL)-3-HYDROXY-1-(5-METHYL-1,2-OXAZOL-3-YL)-2,5-DIHYDRO-1H-PYRROL-2-ONE, 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-(5-methylisoxazol-3-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C20H15BrN2O7 |
|---|---|
| Molecular Weight | 474.01 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.00626 |
| Heavy Atoms | 30 |
| Complexity | 732.0 |
Chemical Identifiers
| CAS Number | 877791-08-7 |
|---|---|
| SMILES | CC1=CC(=NO1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CO3)C4=CC(=C(C(=C4)Br)O)OC |
| InChIKey | CJDXMEZNQPGKSA-UHFFFAOYSA-N |
Product Overview
AB00401659-07 (CAS 877791-08-7), with molecular formula C20H15BrN2O7 and molecular weight 474.01 g/mol. IUPAC: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxazol-3-yl)-2H-pyrrol-5-one.
Chemical Property Profile of AB00401659-07
Property Insights of AB00401659-07
The XLogP value of 3.4 indicates that AB00401659-07 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00401659-07. Following Lipinski's Rule of Five, AB00401659-07 has 2 hydrogen bond donor(s) and 8 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 AB00401659-07?
The CAS number of AB00401659-07 is 877791-08-7.
What is the molecular formula of AB00401659-07?
The molecular formula of AB00401659-07 is C20H15BrN2O7.
What is the molecular weight of AB00401659-07?
The molecular weight of AB00401659-07 is 474.01 g/mol.
Where can I buy AB00401659-07?
You can request a quote for AB00401659-07 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00401659-07?
Yes, KEHONG BIO provides custom synthesis services for AB00401659-07 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.