BAS 05100781
TL;DR: BAS 05100781 (CAS 577757-79-0) is a chemical compound with molecular formula C23H23FN2O3 and molecular weight 394.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(oxolan-2-ylmethyl)benzamide
Also Known As: BAS 05100781, 2-fluoro-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(oxolan-2-ylmethyl)benzamide, 2-fluoro-N-((2-hydroxy-8-methylquinolin-3-yl)methyl)-N-((tetrahydrofuran-2-yl)methyl)benzamide, 2-fluoro-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide
| Molecular Formula | C23H23FN2O3 |
|---|---|
| Molecular Weight | 394.17 g/mol |
| LogP | 3.79702 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.16928 |
| Heavy Atoms | 29 |
| Complexity | 1102.7184 |
Chemical Identifiers
| CAS Number | 577757-79-0 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C=C(C(=O)N2)CN(CC3CCCO3)C(=O)C4=CC=CC=C4F |
Product Overview
BAS 05100781 (CAS 577757-79-0), with molecular formula C23H23FN2O3 and molecular weight 394.17 g/mol. IUPAC: 2-fluoro-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(oxolan-2-ylmethyl)benzamide.
Chemical Property Profile of BAS 05100781
Property Insights of BAS 05100781
The XLogP value of 3.79702 indicates that BAS 05100781 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05100781. Following Lipinski's Rule of Five, BAS 05100781 has 1 hydrogen bond donor(s) and 3 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 BAS 05100781?
The CAS number of BAS 05100781 is 577757-79-0.
What is the molecular formula of BAS 05100781?
The molecular formula of BAS 05100781 is C23H23FN2O3.
What is the molecular weight of BAS 05100781?
The molecular weight of BAS 05100781 is 394.17 g/mol.
Where can I buy BAS 05100781?
You can request a quote for BAS 05100781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05100781?
Yes, KEHONG BIO provides custom synthesis services for BAS 05100781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.