CBKinase1_002789
TL;DR: CBKinase1_002789 (CAS 618376-04-8) is a chemical compound with molecular formula C18H13NO4S2 and molecular weight 371.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-ylmethyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2-thiophen-2-yl-2H-pyrrol-5-one
Also Known As: CBKinase1_002789, CBKinase1_015189, AF-399/41900911, 1-(2-furylmethyl)-3-hydroxy-5-(2-thienyl)-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, 1-(furan-2-ylmethyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2-thiophen-2-yl-2H-pyrrol-5-one
| Molecular Formula | C18H13NO4S2 |
|---|---|
| Molecular Weight | 371.03 g/mol |
| LogP | 4.1811 |
| Topological Polar Surface Area | 70.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.0286 |
| Heavy Atoms | 25 |
| Complexity | 924.06915 |
Chemical Identifiers
| CAS Number | 618376-04-8 |
|---|---|
| SMILES | C1=COC(=C1)CN2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=CS4 |
Product Overview
CBKinase1_002789 (CAS 618376-04-8), with molecular formula C18H13NO4S2 and molecular weight 371.03 g/mol. IUPAC: 1-(furan-2-ylmethyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2-thiophen-2-yl-2H-pyrrol-5-one.
Chemical Property Profile of CBKinase1_002789
Property Insights of CBKinase1_002789
The XLogP value of 4.1811 indicates that CBKinase1_002789 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.75 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002789. Following Lipinski's Rule of Five, CBKinase1_002789 has 1 hydrogen bond donor(s) and 6 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 CBKinase1_002789?
The CAS number of CBKinase1_002789 is 618376-04-8.
What is the molecular formula of CBKinase1_002789?
The molecular formula of CBKinase1_002789 is C18H13NO4S2.
What is the molecular weight of CBKinase1_002789?
The molecular weight of CBKinase1_002789 is 371.03 g/mol.
Where can I buy CBKinase1_002789?
You can request a quote for CBKinase1_002789 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002789?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002789 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.