3-bromo-N,N,4-trimethylbenzamide
TL;DR: 3-bromo-N,N,4-trimethylbenzamide (CAS 201138-75-2) is a chemical compound with molecular formula C10H12BrNO and molecular weight 241.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N,N,4-trimethylbenzamide
Also Known As: 3-bromo-N,N,4-trimethylbenzamide, 3-Bromo-4,N,N-trimethyl-benzamide, 3-Bromo-4,N,N-trimethylbenzamide, 3-bromo-N,N,4-trimethyl-benzamide, 850-292-6
| Molecular Formula | C10H12BrNO |
|---|---|
| Molecular Weight | 241.01 g/mol |
| LogP | 2.45932 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.01022 |
| Heavy Atoms | 13 |
| Complexity | 333.6967 |
Chemical Identifiers
| CAS Number | 201138-75-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)N(C)C)Br |
Product Overview
3-bromo-N,N,4-trimethylbenzamide (CAS 201138-75-2), with molecular formula C10H12BrNO and molecular weight 241.01 g/mol. IUPAC: 3-bromo-N,N,4-trimethylbenzamide.
Chemical Property Profile of 3-bromo-N,N,4-trimethylbenzamide
Property Insights of 3-bromo-N,N,4-trimethylbenzamide
The XLogP value of 2.45932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-bromo-N,N,4-trimethylbenzamide. With a topological polar surface area (TPSA) of 20.31 Ų, 3-bromo-N,N,4-trimethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N,N,4-trimethylbenzamide has 0 hydrogen bond donor(s) and 1 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 3-bromo-N,N,4-trimethylbenzamide?
The CAS number of 3-bromo-N,N,4-trimethylbenzamide is 201138-75-2.
What is the molecular formula of 3-bromo-N,N,4-trimethylbenzamide?
The molecular formula of 3-bromo-N,N,4-trimethylbenzamide is C10H12BrNO.
What is the molecular weight of 3-bromo-N,N,4-trimethylbenzamide?
The molecular weight of 3-bromo-N,N,4-trimethylbenzamide is 241.01 g/mol.
Where can I buy 3-bromo-N,N,4-trimethylbenzamide?
You can request a quote for 3-bromo-N,N,4-trimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N,N,4-trimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N,N,4-trimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.