ASN 05108649
TL;DR: ASN 05108649 (CAS 579459-19-1) is a chemical compound with molecular formula C28H22ClFN2O3S and molecular weight 520.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-[(4-fluorophenyl)methyl]-1-benzothiophene-2-carboxamide
Also Known As: ASN 05108649, Benzo[b]thiophene-2-carboxamide,3-chloro-N-[ methyl]-N-[ methyl]-, 3-chloro-N-[(6-ethoxy-1,2-dihydro-2-oxo-3-quinolinyl)methyl]-N-[(4-fluorophenyl)methyl]-Benzo[b]thiophene-2-carboxamide, 3-Chloro-N-[(6-ethoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-N-(4-fluorobenzyl)-1-benzothiophene-2-carboxamide, 3-chloro-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-[(4-fluorophenyl)methyl]-1-benzothiophene-2-carboxamide
| Molecular Formula | C28H22ClFN2O3S |
|---|---|
| Molecular Weight | 520.10 g/mol |
| LogP | 6.7766 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 520.10236 |
| Heavy Atoms | 36 |
| Complexity | 1628.3093 |
Chemical Identifiers
| CAS Number | 579459-19-1 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=C(C=C3)F)C(=O)C4=C(C5=CC=CC=C5S4)Cl |
Product Overview
ASN 05108649 (CAS 579459-19-1), with molecular formula C28H22ClFN2O3S and molecular weight 520.10 g/mol. IUPAC: 3-chloro-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-[(4-fluorophenyl)methyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of ASN 05108649
Property Insights of ASN 05108649
The XLogP value of 6.7766 indicates that ASN 05108649 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 ASN 05108649. Following Lipinski's Rule of Five, ASN 05108649 has 1 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 ASN 05108649?
The CAS number of ASN 05108649 is 579459-19-1.
What is the molecular formula of ASN 05108649?
The molecular formula of ASN 05108649 is C28H22ClFN2O3S.
What is the molecular weight of ASN 05108649?
The molecular weight of ASN 05108649 is 520.10 g/mol.
Where can I buy ASN 05108649?
You can request a quote for ASN 05108649 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 05108649?
Yes, KEHONG BIO provides custom synthesis services for ASN 05108649 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.