![1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane structure](/static/products/5074/507443-64-3.webp)
1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane
TL;DR: 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane (CAS 507443-64-3) is a chemical compound with molecular formula C20H20F6N2 and molecular weight 402.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane
Also Known As: 1-{bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane, 1-(Bis(4-(trifluoromethyl)phenyl)methyl)-1,4-diazepane, 1-[bis[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane, 1-(BIS[4-(TRIFLUOROMETHYL)PHENYL]METHYL)-1,4-DIAZEPANE
| Molecular Formula | C20H20F6N2 |
|---|---|
| Molecular Weight | 402.15 g/mol |
| LogP | 5.1089 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.15308 |
| Heavy Atoms | 28 |
| Complexity | 699.7683 |
Chemical Identifiers
| CAS Number | 507443-64-3 |
|---|---|
| SMILES | C1CNCCN(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F |
Product Overview
1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane (CAS 507443-64-3), with molecular formula C20H20F6N2 and molecular weight 402.15 g/mol. IUPAC: 1-[bis[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane.
Chemical Property Profile of 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane
Property Insights of 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane
The XLogP value of 5.1089 indicates that 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.27 Ų, 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane 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 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane?
The CAS number of 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane is 507443-64-3.
What is the molecular formula of 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane?
The molecular formula of 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane is C20H20F6N2.
What is the molecular weight of 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane?
The molecular weight of 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane is 402.15 g/mol.
Where can I buy 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane?
You can request a quote for 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane?
Yes, KEHONG BIO provides custom synthesis services for 1-{Bis[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.