![2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide structure](/static/products/1008/1008711-22-5.webp)
2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide
TL;DR: 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide (CAS 1008711-22-5) is a chemical compound with molecular formula C21H24N4O3S and molecular weight 412.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl]-N-(3-methylphenyl)acetamide
Also Known As: 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide, 2-(1-((2-methoxyphenyl)carbamothioyl)-3-oxopiperazin-2-yl)-N-(m-tolyl)acetamide, 2-[1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl]-N-(3-methylphenyl)acetamide, 2-(1-{[(2-methoxyphenyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)-N-(3-methylphenyl)acetamide, 2-(1-{[(2-methoxyphenyl)amino]thioxomethyl}-3-oxopiperazin-2-yl)-N-(3-methylph enyl)acetamide
| Molecular Formula | C21H24N4O3S |
|---|---|
| Molecular Weight | 412.16 g/mol |
| LogP | 2.52962 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.15692 |
| Heavy Atoms | 29 |
| Complexity | 918.30414 |
Chemical Identifiers
| CAS Number | 1008711-22-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CC2C(=O)NCCN2C(=S)NC3=CC=CC=C3OC |
Product Overview
2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide (CAS 1008711-22-5), with molecular formula C21H24N4O3S and molecular weight 412.16 g/mol. IUPAC: 2-[1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl]-N-(3-methylphenyl)acetamide.
Chemical Property Profile of 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide
Property Insights of 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide
The XLogP value of 2.52962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide. Following Lipinski's Rule of Five, 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide has 3 hydrogen bond donor(s) and 4 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-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide?
The CAS number of 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide is 1008711-22-5.
What is the molecular formula of 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide?
The molecular formula of 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide is C21H24N4O3S.
What is the molecular weight of 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide?
The molecular weight of 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide is 412.16 g/mol.
Where can I buy 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide?
You can request a quote for 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{1-[(2-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(3-methylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.