ASN 05103788
TL;DR: ASN 05103788 (CAS 579451-53-9) is a chemical compound with molecular formula C29H24ClFN2O3S and molecular weight 534.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-6-fluoro-N-[(4-methoxyphenyl)methyl]-1-benzothiophene-2-carboxamide
Also Known As: ASN 05103788, Benzo[b]thiophene-2-carboxamide,3-chloro-N-[ methyl]-6-fluoro-N-[ methyl]-, 3-chloro-N-[(1,2-dihydro-7,8-dimethyl-2-oxo-3-quinolinyl)methyl]-6-fluoro-N-[(4-methoxyphenyl)methyl]-Benzo[b]thiophene-2-carboxamide, 3-Chloro-N-[(7,8-dimethyl-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-6-fluoro-N-(4-methoxybenzyl)-1-benzothiophene-2-carboxamide, 3-chloro-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-6-fluoro-N-[(4-methoxyphenyl)methyl]-1-benzothiophene-2-carboxamide
| Molecular Formula | C29H24ClFN2O3S |
|---|---|
| Molecular Weight | 534.12 g/mol |
| LogP | 7.00334 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 534.11804 |
| Heavy Atoms | 37 |
| Complexity | 1709.226 |
Chemical Identifiers
| CAS Number | 579451-53-9 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)OC)C(=O)C4=C(C5=C(S4)C=C(C=C5)F)Cl)C |
Product Overview
ASN 05103788 (CAS 579451-53-9), with molecular formula C29H24ClFN2O3S and molecular weight 534.12 g/mol. IUPAC: 3-chloro-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-6-fluoro-N-[(4-methoxyphenyl)methyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of ASN 05103788
Property Insights of ASN 05103788
The XLogP value of 7.00334 indicates that ASN 05103788 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 05103788. Following Lipinski's Rule of Five, ASN 05103788 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 05103788?
The CAS number of ASN 05103788 is 579451-53-9.
What is the molecular formula of ASN 05103788?
The molecular formula of ASN 05103788 is C29H24ClFN2O3S.
What is the molecular weight of ASN 05103788?
The molecular weight of ASN 05103788 is 534.12 g/mol.
Where can I buy ASN 05103788?
You can request a quote for ASN 05103788 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 05103788?
Yes, KEHONG BIO provides custom synthesis services for ASN 05103788 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.