![N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide structure](/static/products/7572/757221-09-3.webp)
N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide
TL;DR: N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide (CAS 757221-09-3) is a chemical compound with molecular formula C9H11N3OS2 and molecular weight 241.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide
Also Known As: N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide
| Molecular Formula | C9H11N3OS2 |
|---|---|
| Molecular Weight | 241.03 g/mol |
| LogP | 2.1187 |
| Topological Polar Surface Area | 45.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.03435 |
| Heavy Atoms | 15 |
| Complexity | 395.81665 |
Chemical Identifiers
| CAS Number | 757221-09-3 |
|---|---|
| SMILES | CCN(C1=NC(=CS1)CN=C=S)C(=O)C |
Product Overview
N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide (CAS 757221-09-3), with molecular formula C9H11N3OS2 and molecular weight 241.03 g/mol. IUPAC: N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide.
Chemical Property Profile of N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide
Property Insights of N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide
The XLogP value of 2.1187 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide. With a topological polar surface area (TPSA) of 45.56 Ų, N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide has 0 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 N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide?
The CAS number of N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide is 757221-09-3.
What is the molecular formula of N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide?
The molecular formula of N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide is C9H11N3OS2.
What is the molecular weight of N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide?
The molecular weight of N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide is 241.03 g/mol.
Where can I buy N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide?
You can request a quote for N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.