CBKinase1_005641
TL;DR: CBKinase1_005641 (CAS 1093637-94-5) is a chemical compound with molecular formula C25H24N2O4 and molecular weight 416.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-N-(2-methoxyphenyl)-3-phenylpropanamide
Also Known As: CBKinase1_005641, CBKinase1_018041, BRD-A50726765-001-01-9, 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-(2-methoxyphenyl)-3-phenylpropanamide, 2-(1,3-dioxo-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindol-2(3H)-yl)-N-(2-methoxyphenyl)-3-phenylpropanamide
| Molecular Formula | C25H24N2O4 |
|---|---|
| Molecular Weight | 416.17 g/mol |
| LogP | 3.0521 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.1736 |
| Heavy Atoms | 31 |
| Complexity | 1034.2015 |
Chemical Identifiers
| CAS Number | 1093637-94-5 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5CC(C4C3=O)C=C5 |
Product Overview
CBKinase1_005641 (CAS 1093637-94-5), with molecular formula C25H24N2O4 and molecular weight 416.17 g/mol. IUPAC: 2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-N-(2-methoxyphenyl)-3-phenylpropanamide.
Chemical Property Profile of CBKinase1_005641
Property Insights of CBKinase1_005641
The XLogP value of 3.0521 indicates that CBKinase1_005641 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_005641. Following Lipinski's Rule of Five, CBKinase1_005641 has 1 hydrogen bond donor(s) and 4 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_005641?
The CAS number of CBKinase1_005641 is 1093637-94-5.
What is the molecular formula of CBKinase1_005641?
The molecular formula of CBKinase1_005641 is C25H24N2O4.
What is the molecular weight of CBKinase1_005641?
The molecular weight of CBKinase1_005641 is 416.17 g/mol.
Where can I buy CBKinase1_005641?
You can request a quote for CBKinase1_005641 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005641?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005641 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.