KSC-12-71A
TL;DR: KSC-12-71A (CAS 845806-33-9) is a chemical compound with molecular formula C25H26N2O6 and molecular weight 450.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-3-(5-methylfuran-2-carbonyl)-1-(5-methyl-1,2-oxazol-3-yl)-2-(4-pentoxyphenyl)-2H-pyrrol-5-one
Also Known As: KSC-12-71A, (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-[4-(pentyloxy)phenyl]pyrrolidine-2,3-dione, 3-hydroxy-1-(5-methyl-1,2-oxazol-3-yl)-4-(5-methylfuran-2-carbonyl)-5-[4-(pentyloxy)phenyl]-2,5-dihydro-1H-pyrrol-2-one, 3-hydroxy-4-(5-methylfuran-2-carbonyl)-1-(5-methylisoxazol-3-yl)-5-(4-(pentyloxy)phenyl)-1H-pyrrol-2(5H)-one, 3-hydroxy-4-[(5-methylfuran-2-yl)carbonyl]-1-(5-methyl-1,2-oxazol-3-yl)-5-[4-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C25H26N2O6 |
|---|---|
| Molecular Weight | 450.18 g/mol |
| LogP | 5.23634 |
| Topological Polar Surface Area | 106.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 450.17908 |
| Heavy Atoms | 33 |
| Complexity | 1187.7151 |
Chemical Identifiers
| CAS Number | 845806-33-9 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NOC(=C3)C)O)C(=O)C4=CC=C(O4)C |
Product Overview
KSC-12-71A (CAS 845806-33-9), with molecular formula C25H26N2O6 and molecular weight 450.18 g/mol. IUPAC: 4-hydroxy-3-(5-methylfuran-2-carbonyl)-1-(5-methyl-1,2-oxazol-3-yl)-2-(4-pentoxyphenyl)-2H-pyrrol-5-one.
Chemical Property Profile of KSC-12-71A
Property Insights of KSC-12-71A
The XLogP value of 5.23634 indicates that KSC-12-71A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.01 Ų falls within the moderate polarity range, balancing permeability and solubility for KSC-12-71A. Following Lipinski's Rule of Five, KSC-12-71A has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KSC-12-71A?
The CAS number of KSC-12-71A is 845806-33-9.
What is the molecular formula of KSC-12-71A?
The molecular formula of KSC-12-71A is C25H26N2O6.
What is the molecular weight of KSC-12-71A?
The molecular weight of KSC-12-71A is 450.18 g/mol.
Where can I buy KSC-12-71A?
You can request a quote for KSC-12-71A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KSC-12-71A?
Yes, KEHONG BIO provides custom synthesis services for KSC-12-71A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.