Pexacerfont
TL;DR: Pexacerfont (CAS 459856-18-9) is a chemical compound with molecular formula C18H24N6O and molecular weight 340.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2R)-butan-2-yl]-8-(6-methoxy-2-methyl-3-pyridinyl)-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine
Also Known As: PEXACERFONT, pexacerfontum, Pexacerfont [USAN], CRF1 ANTAGONIST, Dpc-a69448
| Molecular Formula | C18H24N6O |
|---|---|
| Molecular Weight | 340.20 g/mol |
| LogP | 3.33056 |
| Topological Polar Surface Area | 77.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.20117 |
| Heavy Atoms | 25 |
| Complexity | 917.56055 |
Chemical Identifiers
| CAS Number | 459856-18-9 |
|---|---|
| SMILES | CC[C@@H](C)NC1=NC(=NC2=C(C(=NN21)C)C3=C(N=C(C=C3)OC)C)C |
Product Overview
Pexacerfont (CAS 459856-18-9), with molecular formula C18H24N6O and molecular weight 340.20 g/mol. IUPAC: N-[(2R)-butan-2-yl]-8-(6-methoxy-2-methyl-3-pyridinyl)-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine.
Chemical Property Profile of Pexacerfont
Property Insights of Pexacerfont
The XLogP value of 3.33056 indicates that Pexacerfont is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.23 Ų falls within the moderate polarity range, balancing permeability and solubility for Pexacerfont. Following Lipinski's Rule of Five, Pexacerfont 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 Pexacerfont?
The CAS number of Pexacerfont is 459856-18-9.
What is the molecular formula of Pexacerfont?
The molecular formula of Pexacerfont is C18H24N6O.
What is the molecular weight of Pexacerfont?
The molecular weight of Pexacerfont is 340.20 g/mol.
Where can I buy Pexacerfont?
You can request a quote for Pexacerfont directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pexacerfont?
Yes, KEHONG BIO provides custom synthesis services for Pexacerfont and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.