2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide
TL;DR: 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide (CAS 887406-79-3) is a chemical compound with molecular formula C15H17NO6S2 and molecular weight 371.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide
Also Known As: MTS-EMCA, N-[2-Methanethiosulfonylethyl]-7-methoxycoumarin-4-acetamide, 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide, 2-(7-methoxy-2-oxo-chromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide, 2-[[2-(7-Methoxy-2-oxo-2H-1-benzopyran-4-yl)acetyl]amino]ethanesulfonothioic Acid
| Molecular Formula | C15H17NO6S2 |
|---|---|
| Molecular Weight | 371.05 g/mol |
| LogP | 0.768 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 371.04974 |
| Heavy Atoms | 24 |
| Complexity | 903.8105 |
Chemical Identifiers
| CAS Number | 887406-79-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NCCS(=O)(=S)OC |
Product Overview
2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide (CAS 887406-79-3), with molecular formula C15H17NO6S2 and molecular weight 371.05 g/mol. IUPAC: 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide.
Chemical Property Profile of 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide
Property Insights of 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide
The XLogP value of 0.768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide. Following Lipinski's Rule of Five, 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide has 1 hydrogen bond donor(s) and 7 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 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide?
The CAS number of 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide is 887406-79-3.
What is the molecular formula of 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide?
The molecular formula of 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide is C15H17NO6S2.
What is the molecular weight of 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide?
The molecular weight of 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide is 371.05 g/mol.
Where can I buy 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide?
You can request a quote for 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(7-methoxy-2-oxochromen-4-yl)-N-(2-methoxysulfonothioylethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.