![4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol structure](/static/products/3787/378771-61-0.webp)
4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol
TL;DR: 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol (CAS 378771-61-0) is a chemical compound with molecular formula C27H28FNO and molecular weight 401.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol
Also Known As: 4-[benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol, 4-(benzyl(tert-butyl)amino)-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol, 4-(benzyl-tert-butyl-amino)-1-(3-fluorophenyl)-1-phenyl-but-2-yn-1-ol
| Molecular Formula | C27H28FNO |
|---|---|
| Molecular Weight | 401.22 g/mol |
| LogP | 5.3657 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.21548 |
| Heavy Atoms | 30 |
| Complexity | 1015.2239 |
Chemical Identifiers
| CAS Number | 378771-61-0 |
|---|---|
| SMILES | CC(C)(C)N(CC#CC(C1=CC=CC=C1)(C2=CC(=CC=C2)F)O)CC3=CC=CC=C3 |
Product Overview
4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol (CAS 378771-61-0), with molecular formula C27H28FNO and molecular weight 401.22 g/mol. IUPAC: 4-[benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol.
Chemical Property Profile of 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol
Property Insights of 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol
The XLogP value of 5.3657 indicates that 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.47 Ų, 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol 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 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol?
The CAS number of 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol is 378771-61-0.
What is the molecular formula of 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol?
The molecular formula of 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol is C27H28FNO.
What is the molecular weight of 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol?
The molecular weight of 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol is 401.22 g/mol.
Where can I buy 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol?
You can request a quote for 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-[Benzyl(tert-butyl)amino]-1-(3-fluorophenyl)-1-phenylbut-2-yn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.