AB00674761-01
TL;DR: AB00674761-01 (CAS 866339-98-2) is a chemical compound with molecular formula C27H21FN2O5 and molecular weight 472.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1-yl]acetamide
Also Known As: AB00674761-01, F1602-0109, N-(2H-1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxo-1,4-dihydroquinolin-1-yl]acetamide, N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1-yl]acetamide, N-(benzo[d][1,3]dioxol-5-yl)-2-(3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1(4H)-yl)acetamide
| Molecular Formula | C27H21FN2O5 |
|---|---|
| Molecular Weight | 472.14 g/mol |
| LogP | 4.35584 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.14346 |
| Heavy Atoms | 35 |
| Complexity | 1574.3789 |
Chemical Identifiers
| CAS Number | 866339-98-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)F)CC(=O)NC4=CC5=C(C=C4)OCO5)C |
Product Overview
AB00674761-01 (CAS 866339-98-2), with molecular formula C27H21FN2O5 and molecular weight 472.14 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1-yl]acetamide.
Chemical Property Profile of AB00674761-01
Property Insights of AB00674761-01
The XLogP value of 4.35584 indicates that AB00674761-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00674761-01. Following Lipinski's Rule of Five, AB00674761-01 has 1 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 AB00674761-01?
The CAS number of AB00674761-01 is 866339-98-2.
What is the molecular formula of AB00674761-01?
The molecular formula of AB00674761-01 is C27H21FN2O5.
What is the molecular weight of AB00674761-01?
The molecular weight of AB00674761-01 is 472.14 g/mol.
Where can I buy AB00674761-01?
You can request a quote for AB00674761-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674761-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674761-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.