2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide
TL;DR: 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide (CAS 866014-49-5) is a chemical compound with molecular formula C13H8Cl3N3OS and molecular weight 358.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-N-[(2-chloro-3-pyridinyl)carbamothioyl]benzamide
Also Known As: 1-(2-chloropyridin-3-yl)-3-(2,4-dichlorobenzoyl)thiourea, F1601-0469, 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide, 2,4-dichloro-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide, [3-(2-chloro-3-pyridyl)thioureido](2,4-dichlorophenyl)methanone
| Molecular Formula | C13H8Cl3N3OS |
|---|---|
| Molecular Weight | 358.95 g/mol |
| LogP | 4.1686 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.94537 |
| Heavy Atoms | 21 |
| Complexity | 708.81085 |
Chemical Identifiers
| CAS Number | 866014-49-5 |
|---|---|
| SMILES | C1=CC(=C(N=C1)Cl)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl |
Product Overview
2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide (CAS 866014-49-5), with molecular formula C13H8Cl3N3OS and molecular weight 358.95 g/mol. IUPAC: 2,4-dichloro-N-[(2-chloro-3-pyridinyl)carbamothioyl]benzamide.
Chemical Property Profile of 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide
Property Insights of 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide
The XLogP value of 4.1686 indicates that 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide has 2 hydrogen bond donor(s) and 3 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-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide?
The CAS number of 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide is 866014-49-5.
What is the molecular formula of 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide?
The molecular formula of 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide is C13H8Cl3N3OS.
What is the molecular weight of 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide?
The molecular weight of 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide is 358.95 g/mol.
Where can I buy 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide?
You can request a quote for 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dichloro-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.