ASN 05110553
TL;DR: ASN 05110553 (CAS 579518-82-4) is a chemical compound with molecular formula C28H20Cl2N2O4S and molecular weight 550.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(2-chlorophenyl)methyl]-N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-1-benzothiophene-2-carboxamide
Also Known As: ASN 05110553, Benzo[b]thiophene-2-carboxamide,3-chloro-N-[ methyl]-N-[ methyl]-, benzo[b]thiophene-2-carboxamide,3-chloro-n-[methyl]-n-[methyl]-, 3-chloro-N-[(2-chlorophenyl)methyl]-N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-1-benzothiophene-2-carboxamide, BENZO[B]THIOPHENE-2-CARBOXAMIDE, 3-CHLORO-N-[(2-CHLOROPHENYL)METHYL]-N-[(2,3,6,7-TETRAHYDRO-7-OXO-1,4-DIOXINO[2,3-G]QUINOLIN-8-YL)METHYL]-
| Molecular Formula | C28H20Cl2N2O4S |
|---|---|
| Molecular Weight | 550.05 g/mol |
| LogP | 6.6634 |
| Topological Polar Surface Area | 71.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 550.05206 |
| Heavy Atoms | 37 |
| Complexity | 1729.2612 |
Chemical Identifiers
| CAS Number | 579518-82-4 |
|---|---|
| SMILES | C1COC2=C(O1)C=C3C=C(C(=O)NC3=C2)CN(CC4=CC=CC=C4Cl)C(=O)C5=C(C6=CC=CC=C6S5)Cl |
Product Overview
ASN 05110553 (CAS 579518-82-4), with molecular formula C28H20Cl2N2O4S and molecular weight 550.05 g/mol. IUPAC: 3-chloro-N-[(2-chlorophenyl)methyl]-N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of ASN 05110553
Property Insights of ASN 05110553
The XLogP value of 6.6634 indicates that ASN 05110553 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.63 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 05110553. Following Lipinski's Rule of Five, ASN 05110553 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 05110553?
The CAS number of ASN 05110553 is 579518-82-4.
What is the molecular formula of ASN 05110553?
The molecular formula of ASN 05110553 is C28H20Cl2N2O4S.
What is the molecular weight of ASN 05110553?
The molecular weight of ASN 05110553 is 550.05 g/mol.
Where can I buy ASN 05110553?
You can request a quote for ASN 05110553 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 05110553?
Yes, KEHONG BIO provides custom synthesis services for ASN 05110553 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.