![2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide structure](/static/products/6986/6986-94-3.webp)
2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide
TL;DR: 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide (CAS 6986-94-3) is a chemical compound with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenoxy)-N-(2-phenylethylcarbamothioyl)acetamide
Also Known As: 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide, 2-(4-nitrophenoxy)-N-(phenethylcarbamothioyl)acetamide, 2-(4-nitrophenoxy)-N-(phenethylthiocarbamoyl)acetamide, 2-(4-nitrophenoxy)-N-{[(2-phenylethyl)amino]carbonothioyl}acetamide
| Molecular Formula | C17H17N3O4S |
|---|---|
| Molecular Weight | 359.09 g/mol |
| LogP | 2.207 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 359.09396 |
| Heavy Atoms | 25 |
| Complexity | 735.318 |
Chemical Identifiers
| CAS Number | 6986-94-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide (CAS 6986-94-3), with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol. IUPAC: 2-(4-nitrophenoxy)-N-(2-phenylethylcarbamothioyl)acetamide.
Chemical Property Profile of 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide
Property Insights of 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide
The XLogP value of 2.207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide. Following Lipinski's Rule of Five, 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide 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 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide?
The CAS number of 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide is 6986-94-3.
What is the molecular formula of 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide?
The molecular formula of 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide is C17H17N3O4S.
What is the molecular weight of 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide?
The molecular weight of 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide is 359.09 g/mol.
Where can I buy 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide?
You can request a quote for 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-nitrophenoxy)-N-[(2-phenylethyl)carbamothioyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.