AB00436434-08
TL;DR: AB00436434-08 (CAS 1164456-47-6) is a chemical compound with molecular formula C27H24N4O5 and molecular weight 484.17468 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]-2-(furan-2-ylmethyl)-3-hydroxy-7-methoxyisoquinolin-1-one
Also Known As: AB00436434-08, 4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]methylidene]-2-(2-furanylmethyl)-7-methoxyisoquinoline-1,3-dione, (4E)-4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]methylidene]-2-(furan-2-ylmethyl)-7-methoxyisoquinoline-1,3-dione, (4Z)-4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]methylidene]-2-(furan-2-ylmethyl)-7-methoxyisoquinoline-1,3-dione, 4-[(1,5-Dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]-2-(furan-2-ylmethyl)-3-hydroxy-7-methoxyisoquinolin-1-one
Technical Specifications
| Molecular Formula | C27H24N4O5 |
| Molecular Weight | 484.17468 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 98.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 484.17468 Da |
| Heavy Atoms | 36 |
| Complexity | 969.0 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(N(C(=O)C4=C3C=CC(=C4)OC)CC5=CC=CO5)O |
| InChIKey | STBQKCFEZSONII-UHFFFAOYSA-N |
Chemical Property Profile of AB00436434-08
Property Insights of AB00436434-08
The XLogP value of 3.2 indicates that AB00436434-08 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00436434-08. Following Lipinski's Rule of Five, AB00436434-08 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AB00436434-08?
The CAS number of AB00436434-08 is 1164456-47-6.
What is the molecular formula of AB00436434-08?
The molecular formula of AB00436434-08 is C27H24N4O5.
What is the molecular weight of AB00436434-08?
The molecular weight of AB00436434-08 is 484.17468 g/mol.
Where can I buy AB00436434-08?
You can request a quote for AB00436434-08 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB00436434-08?
Yes, CoreyChem provides custom synthesis services for AB00436434-08 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.