N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide
TL;DR: N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide (CAS 854041-98-8) is a chemical compound with molecular formula C18H15NO5S and molecular weight 357.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide
Also Known As: N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide, 3-(Methanesulfonyl)-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)benzamide
| Molecular Formula | C18H15NO5S |
|---|---|
| Molecular Weight | 357.07 g/mol |
| LogP | 2.75722 |
| Topological Polar Surface Area | 93.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.0671 |
| Heavy Atoms | 25 |
| Complexity | 1145.5853 |
Chemical Identifiers
| CAS Number | 854041-98-8 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C |
Product Overview
N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide (CAS 854041-98-8), with molecular formula C18H15NO5S and molecular weight 357.07 g/mol. IUPAC: N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide.
Chemical Property Profile of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide
Property Insights of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide
The XLogP value of 2.75722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide. The TPSA of 93.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide. Following Lipinski's Rule of Five, N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide?
The CAS number of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide is 854041-98-8.
What is the molecular formula of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide?
The molecular formula of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide is C18H15NO5S.
What is the molecular weight of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide?
The molecular weight of N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide is 357.07 g/mol.
Where can I buy N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide?
You can request a quote for N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methyl-2-oxochromen-7-yl)-3-methylsulfonylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.