![Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate structure](/static/products/2965/29655-68-3.webp)
Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate
TL;DR: Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate (CAS 29655-68-3) is a chemical compound with molecular formula C10H13NO5S and molecular weight 259.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(methanesulfonamido)-4-methoxybenzoate
Also Known As: methyl 4-methoxy-3-(methylsulfonamido)benzoate, methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate, methyl 3-(methanesulfonamido)-4-methoxybenzoate, A3996/0170319, 4-Methoxy-3-[(methylsulfonyl)amino]benzoic acid methyl ester
| Molecular Formula | C10H13NO5S |
|---|---|
| Molecular Weight | 259.05 g/mol |
| LogP | 0.8533 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.05145 |
| Heavy Atoms | 17 |
| Complexity | 523.49786 |
Chemical Identifiers
| CAS Number | 29655-68-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)OC)NS(=O)(=O)C |
Product Overview
Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate (CAS 29655-68-3), with molecular formula C10H13NO5S and molecular weight 259.05 g/mol. IUPAC: methyl 3-(methanesulfonamido)-4-methoxybenzoate.
Chemical Property Profile of Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate
Property Insights of Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate
The XLogP value of 0.8533 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate. Following Lipinski's Rule of Five, Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate 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 Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate?
The CAS number of Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate is 29655-68-3.
What is the molecular formula of Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate?
The molecular formula of Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate is C10H13NO5S.
What is the molecular weight of Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate?
The molecular weight of Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate is 259.05 g/mol.
Where can I buy Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate?
You can request a quote for Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-methoxy-3-[(methylsulfonyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.