![[2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester structure](/static/products/3097/309736-96-7.webp)
[2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester
TL;DR: [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester (CAS 309736-96-7) is a chemical compound with molecular formula C13H13N3O6S2 and molecular weight 371.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[(3-nitrophenyl)sulfonylamino]-1,3-thiazol-4-yl]acetate
Also Known As: BAS 00407142, ethyl 2-(2-(3-nitrophenylsulfonamido)thiazol-4-yl)acetate, ethyl 2-[2-[(3-nitrophenyl)sulfonylamino]-1,3-thiazol-4-yl]acetate, [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester, ethyl (2-{[(3-nitrophenyl)sulfonyl]amino}-1,3-thiazol-4-yl)acetate
| Molecular Formula | C13H13N3O6S2 |
|---|---|
| Molecular Weight | 371.02 g/mol |
| LogP | 1.9577 |
| Topological Polar Surface Area | 128.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 371.02457 |
| Heavy Atoms | 24 |
| Complexity | 862.0969 |
Chemical Identifiers
| CAS Number | 309736-96-7 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=N1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-] |
Product Overview
[2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester (CAS 309736-96-7), with molecular formula C13H13N3O6S2 and molecular weight 371.02 g/mol. IUPAC: ethyl 2-[2-[(3-nitrophenyl)sulfonylamino]-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester
Property Insights of [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester
The XLogP value of 1.9577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester. The TPSA of 128.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester. Following Lipinski's Rule of Five, [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester has 1 hydrogen bond donor(s) and 8 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-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester?
The CAS number of [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester is 309736-96-7.
What is the molecular formula of [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester?
The molecular formula of [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester is C13H13N3O6S2.
What is the molecular weight of [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester?
The molecular weight of [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester is 371.02 g/mol.
Where can I buy [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester?
You can request a quote for [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for [2-(3-Nitro-benzenesulfonylamino)-thiazol-4-yl]-acetic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.