![[2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester structure](/static/products/3314/331434-88-9.webp)
[2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester
TL;DR: [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester (CAS 331434-88-9) is a chemical compound with molecular formula C14H13IN2O3S and molecular weight 415.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[(4-iodobenzoyl)amino]-1,3-thiazol-4-yl]acetate
Also Known As: BAS 00407089, [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester, ethyl 2-(2-(4-iodobenzamido)thiazol-4-yl)acetate, ethyl 2-[2-[(4-iodobenzoyl)amino]-1,3-thiazol-4-yl]acetate, ethyl {2-[(4-iodobenzoyl)amino]-1,3-thiazol-4-yl}acetate
| Molecular Formula | C14H13IN2O3S |
|---|---|
| Molecular Weight | 415.97 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.96915 |
| Heavy Atoms | 21 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 331434-88-9 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC=C(C=C2)I |
| InChIKey | KKDHSMBZKVEVDD-UHFFFAOYSA-N |
Product Overview
[2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester (CAS 331434-88-9), with molecular formula C14H13IN2O3S and molecular weight 415.97 g/mol. IUPAC: ethyl 2-[2-[(4-iodobenzoyl)amino]-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester
Property Insights of [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester
The XLogP value of 3.0 indicates that [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester. Following Lipinski's Rule of Five, [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester 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 [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester?
The CAS number of [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester is 331434-88-9.
What is the molecular formula of [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester?
The molecular formula of [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester is C14H13IN2O3S.
What is the molecular weight of [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester?
The molecular weight of [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester is 415.97 g/mol.
Where can I buy [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester?
You can request a quote for [2-(4-Iodo-benzoylamino)-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-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Iodo-benzoylamino)-thiazol-4-yl]-acetic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.