![N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide structure](/static/products/7082/708227-04-7.webp)
N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide
TL;DR: N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide (CAS 708227-04-7) is a chemical compound with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide
Also Known As: N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide, N-(3-{[(3-chloro-2-methylphenyl)carbamothioyl]amino}phenyl)acetamide, N-[3-({[(3-chloro-2-methylphenyl)amino]thioxomethyl}amino)phenyl]acetamide, N-[3-({[(3-chloro-2-methylphenyl)amino]carbonothioyl}amino)phenyl]acetamide
| Molecular Formula | C16H16ClN3OS |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 4.41572 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.07025 |
| Heavy Atoms | 22 |
| Complexity | 718.2872 |
Chemical Identifiers
| CAS Number | 708227-04-7 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=S)NC2=CC=CC(=C2)NC(=O)C |
Product Overview
N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide (CAS 708227-04-7), with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol. IUPAC: N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide.
Chemical Property Profile of N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide
Property Insights of N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide
The XLogP value of 4.41572 indicates that N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide has 3 hydrogen bond donor(s) and 2 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-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide?
The CAS number of N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide is 708227-04-7.
What is the molecular formula of N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide?
The molecular formula of N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide is C16H16ClN3OS.
What is the molecular weight of N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide?
The molecular weight of N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide is 333.07 g/mol.
Where can I buy N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide?
You can request a quote for N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-[(3-chloro-2-methylphenyl)carbamothioylamino]phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.