ASN 05110316
TL;DR: ASN 05110316 (CAS 579518-30-2) is a chemical compound with molecular formula C26H22ClFN2O5S and molecular weight 528.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-6-fluoro-N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(oxolan-2-ylmethyl)-1-benzothiophene-2-carboxamide
Also Known As: ASN 05110316, 3-chloro-6-fluoro-N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(oxolan-2-ylmethyl)-1-benzothiophene-2-carboxamide, 3-Chloro-6-fluoro-N-[(8-oxo-2,3,8,9-tetrahydronaphtho[2,3-b][1,4]dioxin-7-yl)methyl]-N-(tetrahydro-2-furanylmethyl)-1-benzothiophene-2-carboxamide, BENZO[B]THIOPHENE-2-CARBOXAMIDE, 3-CHLORO-6-FLUORO-N-[(TETRAHYDRO-2-FURANYL)METHYL]-N-[(2,3,6,7-TETRAHYDRO-7-OXO-1,4-DIOXINO[2,3-G]QUINOLIN-8-YL)METHYL]-
| Molecular Formula | C26H22ClFN2O5S |
|---|---|
| Molecular Weight | 528.09 g/mol |
| LogP | 5.1279 |
| Topological Polar Surface Area | 80.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 528.0922 |
| Heavy Atoms | 36 |
| Complexity | 1545.1554 |
Chemical Identifiers
| CAS Number | 579518-30-2 |
|---|---|
| SMILES | C1CC(OC1)CN(CC2=CC3=CC4=C(C=C3NC2=O)OCCO4)C(=O)C5=C(C6=C(S5)C=C(C=C6)F)Cl |
Product Overview
ASN 05110316 (CAS 579518-30-2), with molecular formula C26H22ClFN2O5S and molecular weight 528.09 g/mol. IUPAC: 3-chloro-6-fluoro-N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(oxolan-2-ylmethyl)-1-benzothiophene-2-carboxamide.
Chemical Property Profile of ASN 05110316
Property Insights of ASN 05110316
The XLogP value of 5.1279 indicates that ASN 05110316 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 05110316. Following Lipinski's Rule of Five, ASN 05110316 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 05110316?
The CAS number of ASN 05110316 is 579518-30-2.
What is the molecular formula of ASN 05110316?
The molecular formula of ASN 05110316 is C26H22ClFN2O5S.
What is the molecular weight of ASN 05110316?
The molecular weight of ASN 05110316 is 528.09 g/mol.
Where can I buy ASN 05110316?
You can request a quote for ASN 05110316 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 05110316?
Yes, KEHONG BIO provides custom synthesis services for ASN 05110316 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.