N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide
TL;DR: N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide (CAS 883965-85-3) is a chemical compound with molecular formula C25H21NO4S and molecular weight 431.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(3,4-dimethoxyphenyl)-4-oxothiochromen-2-yl]-4-methylbenzamide
Also Known As: N-[3-(3,4-dimethoxyphenyl)-4-oxothiochromen-2-yl]-4-methylbenzamide, N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide, N-[3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl]-4-methylbenzamide, N-[3-(3,4-dimethoxyphenyl)-4-oxo-thiochromen-2-yl]-4-methyl-benzamide
| Molecular Formula | C25H21NO4S |
|---|---|
| Molecular Weight | 431.12 g/mol |
| LogP | 5.50642 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.11914 |
| Heavy Atoms | 31 |
| Complexity | 1325.9313 |
Chemical Identifiers
| CAS Number | 883965-85-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=C(C(=O)C3=CC=CC=C3S2)C4=CC(=C(C=C4)OC)OC |
Product Overview
N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide (CAS 883965-85-3), with molecular formula C25H21NO4S and molecular weight 431.12 g/mol. IUPAC: N-[3-(3,4-dimethoxyphenyl)-4-oxothiochromen-2-yl]-4-methylbenzamide.
Chemical Property Profile of N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide
Property Insights of N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide
The XLogP value of 5.50642 indicates that N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide. Following Lipinski's Rule of Five, N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide 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 N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide?
The CAS number of N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide is 883965-85-3.
What is the molecular formula of N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide?
The molecular formula of N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide is C25H21NO4S.
What is the molecular weight of N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide?
The molecular weight of N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide is 431.12 g/mol.
Where can I buy N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide?
You can request a quote for N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(3,4-dimethoxyphenyl)-4-oxo-4H-thiochromen-2-yl)-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.