![5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide structure](/static/products/4319/431928-61-9.webp)
5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide
TL;DR: 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide (CAS 431928-61-9) is a chemical compound with molecular formula C15H14BrN3OS and molecular weight 363.0041 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide
Also Known As: AB00116628-01, AN-465/40811417, N-[(5-bromo-3-pyridinyl)carbonyl]-N'-(2,4-dimethylphenyl)thiourea, 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide
Technical Specifications
| Molecular Formula | C15H14BrN3OS |
| Molecular Weight | 363.0041 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 86.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 363.0041 Da |
| Heavy Atoms | 21 |
| Complexity | 393.0 |
| SMILES | CC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC(=CN=C2)Br)C |
| InChIKey | FQXRXXPMHXMASY-UHFFFAOYSA-N |
Chemical Property Profile of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide
Property Insights of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide
The XLogP value of 3.9 indicates that 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide. Following Lipinski's Rule of Five, 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide 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
What is the CAS number of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide?
The CAS number of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide is 431928-61-9.
What is the molecular formula of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide?
The molecular formula of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide is C15H14BrN3OS.
What is the molecular weight of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide?
The molecular weight of 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide is 363.0041 g/mol.
Where can I buy 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide?
You can request a quote for 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide?
Yes, CoreyChem provides custom synthesis services for 5-bromo-N-[(2,4-dimethylphenyl)carbamothioyl]pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.