1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone
TL;DR: 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone (CAS 727664-79-1) is a chemical compound with molecular formula C11H11N3OS and molecular weight 233.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-amino-2-anilino-1,3-thiazol-5-yl)ethanone
Also Known As: 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone, 1-(4-Amino-2-phenylaminothiazol-5-yl)ethanone, 1-(2-Anilino-4-aminothiazole-5-yl)ethanone, 1-(4-amino-2-phenylamino-thiazol-5-yl)-ethanone, J3.281.997D
| Molecular Formula | C11H11N3OS |
|---|---|
| Molecular Weight | 233.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.06229 |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 727664-79-1 |
|---|---|
| SMILES | CC(=O)C1=C(N=C(S1)NC2=CC=CC=C2)N |
| InChIKey | ZYCCMMGEMIRHJZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone (CAS 727664-79-1), with molecular formula C11H11N3OS and molecular weight 233.06 g/mol. IUPAC: 1-(4-amino-2-anilino-1,3-thiazol-5-yl)ethanone.
Chemical Property Profile of 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone
Property Insights of 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone
The XLogP value of 3.0 indicates that 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone. Following Lipinski's Rule of Five, 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone has 2 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-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone?
The CAS number of 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone is 727664-79-1.
What is the molecular formula of 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone?
The molecular formula of 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone is C11H11N3OS.
What is the molecular weight of 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone?
The molecular weight of 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone is 233.06 g/mol.
Where can I buy 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone?
You can request a quote for 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Amino-2-(phenylamino)thiazol-5-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.