Pak 104P
TL;DR: Pak 104P (CAS 131356-86-0) is a chemical compound with molecular formula C38H43N4O7P and molecular weight 698.2869 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-benzhydrylpiperazin-1-yl)ethyl 5-(4,6-dimethyl-2-oxo-1,3,2λ5-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3-carboxylate
Also Known As: Pak 104P, Pak-104P, 2-(4-benzhydrylpiperazin-1-yl)ethyl 5-(4,6-dimethyl-2-oxo-1,3,2, 2-(4-(Diphenylmethyl)-1-piperazinyl)ethyl 5-(4,6-dimethyl-1,3,2-dioxaphosphorinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-3-pyridinecarboxylate P-oxide, 2-(4-Benzhydrylpiperazin-1-yl)ethyl 5-(4,6-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3-carboxylate
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C38H43N4O7P |
| Molecular Weight | 698.2869 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 127.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 698.2869 Da |
| Heavy Atoms | 50 |
| Complexity | 1140.0 |
| SMILES | CC1CC(OP(=O)(O1)C2=C(C(=C(N=C2C)C)C(=O)OCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC(=CC=C6)[N+](=O)[O-])C |
| InChIKey | PFKHLXIJSNUZDT-UHFFFAOYSA-N |
Chemical Property Profile of Pak 104P
Property Insights of Pak 104P
The XLogP value of 6.1 indicates that Pak 104P is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pak 104P. Following Lipinski's Rule of Five, Pak 104P has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Pak 104P?
The CAS number of Pak 104P is 131356-86-0.
What is the molecular formula of Pak 104P?
The molecular formula of Pak 104P is C38H43N4O7P.
What is the molecular weight of Pak 104P?
The molecular weight of Pak 104P is 698.2869 g/mol.
Where can I buy Pak 104P?
You can request a quote for Pak 104P directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pak 104P?
Yes, CoreyChem provides custom synthesis services for Pak 104P and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.