AP-845/42065398
TL;DR: AP-845/42065398 (CAS 384368-54-1) is a chemical compound with molecular formula C21H25N3O2S and molecular weight 383.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-piperidin-1-ylethanone
Also Known As: AP-845/42065398, 1-(5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)-2-(piperidin-1-yl)ethanone, 1-[5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(piperidin-1-yl)ethan-1-one, 1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-piperidin-1-ylethanone, 1-{2-[5-(4-methoxyphenyl)-3-(2-thienyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine
| Molecular Formula | C21H25N3O2S |
|---|---|
| Molecular Weight | 383.17 g/mol |
| LogP | 3.9203 |
| Topological Polar Surface Area | 45.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.16675 |
| Heavy Atoms | 27 |
| Complexity | 795.34406 |
Chemical Identifiers
| CAS Number | 384368-54-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC(=NN2C(=O)CN3CCCCC3)C4=CC=CS4 |
Product Overview
AP-845/42065398 (CAS 384368-54-1), with molecular formula C21H25N3O2S and molecular weight 383.17 g/mol. IUPAC: 1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-piperidin-1-ylethanone.
Chemical Property Profile of AP-845/42065398
Property Insights of AP-845/42065398
The XLogP value of 3.9203 indicates that AP-845/42065398 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.14 Ų, AP-845/42065398 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-845/42065398 has 0 hydrogen bond donor(s) and 5 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 AP-845/42065398?
The CAS number of AP-845/42065398 is 384368-54-1.
What is the molecular formula of AP-845/42065398?
The molecular formula of AP-845/42065398 is C21H25N3O2S.
What is the molecular weight of AP-845/42065398?
The molecular weight of AP-845/42065398 is 383.17 g/mol.
Where can I buy AP-845/42065398?
You can request a quote for AP-845/42065398 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-845/42065398?
Yes, KEHONG BIO provides custom synthesis services for AP-845/42065398 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.