3W-0321
TL;DR: 3W-0321 (CAS 865658-52-2) is a chemical compound with molecular formula C28H26FN3O2 and molecular weight 455.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(2-fluorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]-N-[(4-methoxyphenyl)methyl]benzamide
Also Known As: 3W-0321, 4-[3-(2-fluorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]-N-[(4-methoxyphenyl)methyl]benzamide, 4-[3-(2-fluorophenyl)-4,5,6,7-tetrahydro-2H-indazol-2-yl]-N-(4-methoxybenzyl)benzenecarboxamide, 4-[3-(2-fluorophenyl)-4,5,6,7-tetrahydro-2H-indazol-2-yl]-N-[(4-methoxyphenyl)methyl]benzamide
| Molecular Formula | C28H26FN3O2 |
|---|---|
| Molecular Weight | 455.20 g/mol |
| LogP | 5.4958 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.2009 |
| Heavy Atoms | 34 |
| Complexity | 1310.743 |
Chemical Identifiers
| CAS Number | 865658-52-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3C(=C4CCCCC4=N3)C5=CC=CC=C5F |
Product Overview
3W-0321 (CAS 865658-52-2), with molecular formula C28H26FN3O2 and molecular weight 455.20 g/mol. IUPAC: 4-[3-(2-fluorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]-N-[(4-methoxyphenyl)methyl]benzamide.
Chemical Property Profile of 3W-0321
Property Insights of 3W-0321
The XLogP value of 5.4958 indicates that 3W-0321 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.15 Ų, 3W-0321 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3W-0321 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3W-0321?
The CAS number of 3W-0321 is 865658-52-2.
What is the molecular formula of 3W-0321?
The molecular formula of 3W-0321 is C28H26FN3O2.
What is the molecular weight of 3W-0321?
The molecular weight of 3W-0321 is 455.20 g/mol.
Where can I buy 3W-0321?
You can request a quote for 3W-0321 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3W-0321?
Yes, KEHONG BIO provides custom synthesis services for 3W-0321 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.