![[[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate structure](/static/products/6729/672925-63-2.webp)
[[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate
TL;DR: [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate (CAS 672925-63-2) is a chemical compound with molecular formula C16H16N2O4S and molecular weight 332.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[1-amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate
Also Known As: [[1-amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate, N'-[(3-methylbenzoyl)oxy]-2-(phenylsulfonyl)ethanimidamide
| Molecular Formula | C16H16N2O4S |
|---|---|
| Molecular Weight | 332.08 g/mol |
| LogP | 1.89792 |
| Topological Polar Surface Area | 98.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.08307 |
| Heavy Atoms | 23 |
| Complexity | 830.1686 |
Chemical Identifiers
| CAS Number | 672925-63-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)ON=C(CS(=O)(=O)C2=CC=CC=C2)N |
Product Overview
[[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate (CAS 672925-63-2), with molecular formula C16H16N2O4S and molecular weight 332.08 g/mol. IUPAC: [[1-amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate.
Chemical Property Profile of [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate
Property Insights of [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate
The XLogP value of 1.89792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate. The TPSA of 98.82 Ų falls within the moderate polarity range, balancing permeability and solubility for [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate. Following Lipinski's Rule of Five, [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate 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 [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate?
The CAS number of [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate is 672925-63-2.
What is the molecular formula of [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate?
The molecular formula of [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate is C16H16N2O4S.
What is the molecular weight of [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate?
The molecular weight of [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate is 332.08 g/mol.
Where can I buy [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate?
You can request a quote for [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [[1-Amino-2-(benzenesulfonyl)ethylidene]amino] 3-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.