9X-0076
TL;DR: 9X-0076 (CAS 1030937-43-9) is a chemical compound with molecular formula C24H19Cl2N3O2 and molecular weight 451.08542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]naphthalene-1,4-dione
Also Known As: 9X-0076, 2-chloro-3-{4-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]piperidin-1-yl}-1,4-dihydronaphthalene-1,4-dione, 2-chloro-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]naphthalene-1,4-dione, 2-chloro-3-{4-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]piperidino}naphthoquinone, 2-chloro-3-{4-[5-(4-chlorophenyl)-2H-pyrazol-3-yl]piperidin-1-yl}naphthalene-1,4-dione
Technical Specifications
| Molecular Formula | C24H19Cl2N3O2 |
| Molecular Weight | 451.08542 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 451.08542 Da |
| Heavy Atoms | 31 |
| Complexity | 741.0 |
| SMILES | C1CN(CCC1C2=CC(=NN2)C3=CC=C(C=C3)Cl)C4=C(C(=O)C5=CC=CC=C5C4=O)Cl |
| InChIKey | UYISFUVLYQSVAN-UHFFFAOYSA-N |
Chemical Property Profile of 9X-0076
Property Insights of 9X-0076
The XLogP value of 5.5 indicates that 9X-0076 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 9X-0076. Following Lipinski's Rule of Five, 9X-0076 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 9X-0076?
The CAS number of 9X-0076 is 1030937-43-9.
What is the molecular formula of 9X-0076?
The molecular formula of 9X-0076 is C24H19Cl2N3O2.
What is the molecular weight of 9X-0076?
The molecular weight of 9X-0076 is 451.08542 g/mol.
Where can I buy 9X-0076?
You can request a quote for 9X-0076 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9X-0076?
Yes, CoreyChem provides custom synthesis services for 9X-0076 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.