![2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide structure](/static/products/4454/445420-04-2.webp)
2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide
TL;DR: 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide (CAS 445420-04-2) is a chemical compound with molecular formula C17H16ClIN2OS and molecular weight 457.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide
Also Known As: 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide, AN-465/41168305, N-(2-chloro-5-iodobenzoyl)-N'-mesitylthiourea, N-(2-Chloro-5-iodobenzoyl)-N/'-mesitylthiourea
| Molecular Formula | C17H16ClIN2OS |
|---|---|
| Molecular Weight | 457.97 g/mol |
| LogP | 4.99666 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 457.97165 |
| Heavy Atoms | 23 |
| Complexity | 769.1531 |
Chemical Identifiers
| CAS Number | 445420-04-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl)C |
Product Overview
2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide (CAS 445420-04-2), with molecular formula C17H16ClIN2OS and molecular weight 457.97 g/mol. IUPAC: 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide
Property Insights of 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide
The XLogP value of 4.99666 indicates that 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide has 2 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 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide?
The CAS number of 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide is 445420-04-2.
What is the molecular formula of 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide?
The molecular formula of 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide is C17H16ClIN2OS.
What is the molecular weight of 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide?
The molecular weight of 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide is 457.97 g/mol.
Where can I buy 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide?
You can request a quote for 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-5-iodo-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.