![N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide structure](/static/products/4296/429653-06-5.webp)
N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide
TL;DR: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide (CAS 429653-06-5) is a chemical compound with molecular formula C12H15BrN2OS and molecular weight 314.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide
Also Known As: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide, N-(4-bromo-2,6-dimethylphenyl)-N'-propionylthiourea, N-{[(4-bromo-2,6-dimethylphenyl)amino]thioxomethyl}propanamide, N-{[(4-bromo-2,6-dimethylphenyl)amino]carbonothioyl}propanamide
| Molecular Formula | C12H15BrN2OS |
|---|---|
| Molecular Weight | 314.01 g/mol |
| LogP | 3.28894 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.00885 |
| Heavy Atoms | 17 |
| Complexity | 436.814 |
Chemical Identifiers
| CAS Number | 429653-06-5 |
|---|---|
| SMILES | CCC(=O)NC(=S)NC1=C(C=C(C=C1C)Br)C |
Product Overview
N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide (CAS 429653-06-5), with molecular formula C12H15BrN2OS and molecular weight 314.01 g/mol. IUPAC: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide.
Chemical Property Profile of N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide
Property Insights of N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide
The XLogP value of 3.28894 indicates that N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide 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-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide 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-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide?
The CAS number of N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide is 429653-06-5.
What is the molecular formula of N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide?
The molecular formula of N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide is C12H15BrN2OS.
What is the molecular weight of N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide?
The molecular weight of N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide is 314.01 g/mol.
Where can I buy N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide?
You can request a quote for N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.