3-溴-2-苯基喹啉
TL;DR: 3-溴-2-苯基喹啉 (CAS 5428-24-0) is a chemical compound with molecular formula C19H40N2S and molecular weight 328.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-溴-2-苯基喹啉
hexadecyl N,N'-dimethylcarbamimidothioate
Also Known As: hexadecyl n,n'-dimethylcarbamimidothioate
| Molecular Formula | C19H40N2S |
|---|---|
| Molecular Weight | 328.29 g/mol |
| LogP | 8.4 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 328.29123 |
| Heavy Atoms | 22 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 5428-24-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCSC(=NC)NC |
| InChIKey | LFUDDCATZJRGGH-UHFFFAOYSA-N |
Product Overview
3-溴-2-苯基喹啉 (CAS 5428-24-0), with molecular formula C19H40N2S and molecular weight 328.29 g/mol. IUPAC: hexadecyl N,N'-dimethylcarbamimidothioate.
Chemical Property Profile of 3-溴-2-苯基喹啉
Property Insights of 3-溴-2-苯基喹啉
The XLogP value of 8.4 indicates that 3-溴-2-苯基喹啉 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 3-溴-2-苯基喹啉 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-溴-2-苯基喹啉 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-溴-2-苯基喹啉?
The CAS number of 3-溴-2-苯基喹啉 is 5428-24-0.
What is the molecular formula of 3-溴-2-苯基喹啉?
The molecular formula of 3-溴-2-苯基喹啉 is C19H40N2S.
What is the molecular weight of 3-溴-2-苯基喹啉?
The molecular weight of 3-溴-2-苯基喹啉 is 328.29 g/mol.
Where can I buy 3-溴-2-苯基喹啉?
You can request a quote for 3-溴-2-苯基喹啉 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-溴-2-苯基喹啉?
Yes, KEHONG BIO provides custom synthesis services for 3-溴-2-苯基喹啉 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.