CBKinase1_003819
TL;DR: CBKinase1_003819 (CAS 618368-67-5) is a chemical compound with molecular formula C23H16N2O5 and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzofuran-2-carbonyl)-1-(furan-2-ylmethyl)-4-hydroxy-2-pyridin-3-yl-2H-pyrrol-5-one
Also Known As: CBKinase1_003819, CBKinase1_016219, AS-871/42016700, 3-(1-benzofuran-2-carbonyl)-1-(furan-2-ylmethyl)-4-hydroxy-2-pyridin-3-yl-2H-pyrrol-5-one, 4-(1-benzofuran-2-ylcarbonyl)-1-(2-furylmethyl)-3-hydroxy-5-(3-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C23H16N2O5 |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 4.1993 |
| Topological Polar Surface Area | 96.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.10593 |
| Heavy Atoms | 30 |
| Complexity | 1238.4417 |
Chemical Identifiers
| CAS Number | 618368-67-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C(=O)C3=C(C(=O)N(C3C4=CN=CC=C4)CC5=CC=CO5)O |
Product Overview
CBKinase1_003819 (CAS 618368-67-5), with molecular formula C23H16N2O5 and molecular weight 400.11 g/mol. IUPAC: 3-(1-benzofuran-2-carbonyl)-1-(furan-2-ylmethyl)-4-hydroxy-2-pyridin-3-yl-2H-pyrrol-5-one.
Chemical Property Profile of CBKinase1_003819
Property Insights of CBKinase1_003819
The XLogP value of 4.1993 indicates that CBKinase1_003819 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.78 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003819. Following Lipinski's Rule of Five, CBKinase1_003819 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_003819?
The CAS number of CBKinase1_003819 is 618368-67-5.
What is the molecular formula of CBKinase1_003819?
The molecular formula of CBKinase1_003819 is C23H16N2O5.
What is the molecular weight of CBKinase1_003819?
The molecular weight of CBKinase1_003819 is 400.11 g/mol.
Where can I buy CBKinase1_003819?
You can request a quote for CBKinase1_003819 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003819?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003819 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.