1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane
TL;DR: 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane (CAS 849909-00-8) is a chemical compound with molecular formula C33H36N2O2 and molecular weight 492.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
Also Known As: 1,4-bis(4-(benzyloxy)benzyl)-1,4-diazepane, 1,4-bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane, 1,4-bis[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane, 1H-1,4-Diazepine, hexahydro-1,4-bis[[4-(phenylmethoxy)phenyl]methyl]-
| Molecular Formula | C33H36N2O2 |
|---|---|
| Molecular Weight | 492.28 g/mol |
| LogP | 6.5525 |
| Topological Polar Surface Area | 24.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 492.27768 |
| Heavy Atoms | 37 |
| Complexity | 1097.798 |
Chemical Identifiers
| CAS Number | 849909-00-8 |
|---|---|
| SMILES | C1CN(CCN(C1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)OCC5=CC=CC=C5 |
Product Overview
1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane (CAS 849909-00-8), with molecular formula C33H36N2O2 and molecular weight 492.28 g/mol. IUPAC: 1,4-bis[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane.
Chemical Property Profile of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane
Property Insights of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane
The XLogP value of 6.5525 indicates that 1,4-Bis[(4-benzyloxyphenyl)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 24.94 Ų, 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane?
The CAS number of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane is 849909-00-8.
What is the molecular formula of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane?
The molecular formula of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane is C33H36N2O2.
What is the molecular weight of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane?
The molecular weight of 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane is 492.28 g/mol.
Where can I buy 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane?
You can request a quote for 1,4-Bis[(4-benzyloxyphenyl)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 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis[(4-benzyloxyphenyl)methyl]-1,4-diazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.