![2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate structure](/static/products/7498/749872-44-4.webp)
2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
TL;DR: 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate (CAS 749872-44-4) is a chemical compound with molecular formula C15H19ClN2O6S and molecular weight 390.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate
Also Known As: 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate, [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate, 2-[(1,1-Dioxo-1lambda~6~-thiolan-3-yl)(methyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
| Molecular Formula | C15H19ClN2O6S |
|---|---|
| Molecular Weight | 390.07 g/mol |
| LogP | 0.7331 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.06525 |
| Heavy Atoms | 25 |
| Complexity | 795.4565 |
Chemical Identifiers
| CAS Number | 749872-44-4 |
|---|---|
| SMILES | CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C2=CC(=C(C=C2OC)N)Cl |
Product Overview
2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate (CAS 749872-44-4), with molecular formula C15H19ClN2O6S and molecular weight 390.07 g/mol. IUPAC: [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate.
Chemical Property Profile of 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
Property Insights of 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
The XLogP value of 0.7331 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate. Following Lipinski's Rule of Five, 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate 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-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
The CAS number of 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate is 749872-44-4.
What is the molecular formula of 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
The molecular formula of 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate is C15H19ClN2O6S.
What is the molecular weight of 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
The molecular weight of 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate is 390.07 g/mol.
Where can I buy 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
You can request a quote for 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.