AB00684877-01
TL;DR: AB00684877-01 (CAS 847396-16-1) is a chemical compound with molecular formula C27H26FN3O3 and molecular weight 459.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-fluorophenyl)-4-[1-[3-(4-methoxyphenoxy)propyl]benzimidazol-2-yl]pyrrolidin-2-one
Also Known As: AB00684877-01, 1-(2-fluorophenyl)-4-{1-[3-(4-methoxyphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one, F0660-1538, 1-(2-fluorophenyl)-4-[1-[3-(4-methoxyphenoxy)propyl]benzimidazol-2-yl]pyrrolidin-2-one, 1-(2-fluorophenyl)-4-{1-[3-(4-methoxyphenoxy)propyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
| Molecular Formula | C27H26FN3O3 |
|---|---|
| Molecular Weight | 459.20 g/mol |
| LogP | 5.1736 |
| Topological Polar Surface Area | 56.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.19583 |
| Heavy Atoms | 34 |
| Complexity | 1302.2317 |
Chemical Identifiers
| CAS Number | 847396-16-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OCCCN2C3=CC=CC=C3N=C2C4CC(=O)N(C4)C5=CC=CC=C5F |
Product Overview
AB00684877-01 (CAS 847396-16-1), with molecular formula C27H26FN3O3 and molecular weight 459.20 g/mol. IUPAC: 1-(2-fluorophenyl)-4-[1-[3-(4-methoxyphenoxy)propyl]benzimidazol-2-yl]pyrrolidin-2-one.
Chemical Property Profile of AB00684877-01
Property Insights of AB00684877-01
The XLogP value of 5.1736 indicates that AB00684877-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.59 Ų, AB00684877-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00684877-01 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00684877-01?
The CAS number of AB00684877-01 is 847396-16-1.
What is the molecular formula of AB00684877-01?
The molecular formula of AB00684877-01 is C27H26FN3O3.
What is the molecular weight of AB00684877-01?
The molecular weight of AB00684877-01 is 459.20 g/mol.
Where can I buy AB00684877-01?
You can request a quote for AB00684877-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684877-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684877-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.