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N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide
TL;DR: N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide (CAS 428449-65-4) is a chemical compound with molecular formula C14H9Cl2IN2OS and molecular weight 449.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide
Also Known As: N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide, N-(3,5-dichlorophenyl)-N'-(3-iodobenzoyl)thiourea, N-(3,5-Dichlorophenyl)-N/'-(3-iodobenzoyl)thiourea
| Molecular Formula | C14H9Cl2IN2OS |
|---|---|
| Molecular Weight | 449.89 g/mol |
| LogP | 4.7248 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 449.88574 |
| Heavy Atoms | 21 |
| Complexity | 688.8734 |
Chemical Identifiers
| CAS Number | 428449-65-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)I)C(=O)NC(=S)NC2=CC(=CC(=C2)Cl)Cl |
Product Overview
N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide (CAS 428449-65-4), with molecular formula C14H9Cl2IN2OS and molecular weight 449.89 g/mol. IUPAC: N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide.
Chemical Property Profile of N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide
Property Insights of N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide
The XLogP value of 4.7248 indicates that N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide 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 N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide?
The CAS number of N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide is 428449-65-4.
What is the molecular formula of N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide?
The molecular formula of N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide is C14H9Cl2IN2OS.
What is the molecular weight of N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide?
The molecular weight of N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide is 449.89 g/mol.
Where can I buy N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide?
You can request a quote for N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,5-dichlorophenyl)carbamothioyl]-3-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.