![N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide structure](/static/products/3352/335213-06-4.webp)
N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide
TL;DR: N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide (CAS 335213-06-4) is a chemical compound with molecular formula C15H14BrN3OS and molecular weight 363.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-bromo-2-pyridinyl)carbamothioyl]-3,4-dimethylbenzamide
Also Known As: N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide, N-[(5-bromopyridin-2-yl)thiocarbamoyl]-3,4-dimethyl-benzamide, (3,4-dimethylphenyl)-N-{[(5-bromo(2-pyridyl))amino]thioxomethyl}carboxamide
| Molecular Formula | C15H14BrN3OS |
|---|---|
| Molecular Weight | 363.00 g/mol |
| LogP | 3.58774 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 363.0041 |
| Heavy Atoms | 21 |
| Complexity | 685.8181 |
Chemical Identifiers
| CAS Number | 335213-06-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br)C |
Product Overview
N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide (CAS 335213-06-4), with molecular formula C15H14BrN3OS and molecular weight 363.00 g/mol. IUPAC: N-[(5-bromo-2-pyridinyl)carbamothioyl]-3,4-dimethylbenzamide.
Chemical Property Profile of N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide
Property Insights of N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide
The XLogP value of 3.58774 indicates that N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide 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 N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide?
The CAS number of N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide is 335213-06-4.
What is the molecular formula of N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide?
The molecular formula of N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide is C15H14BrN3OS.
What is the molecular weight of N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide?
The molecular weight of N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide is 363.00 g/mol.
Where can I buy N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide?
You can request a quote for N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.