![5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine structure](/static/products/111/111336-87-9.png)
5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine
TL;DR: 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine (CAS 111336-87-9) is a chemical compound with molecular formula C25H21BrN4 and molecular weight 456.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-bromophenyl)-3-methyl-1,7-diphenyl-7,8-dihydro-6H-pyrazolo[4,5-b][1,4]diazepine
Also Known As: 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine
| Molecular Formula | C25H21BrN4 |
|---|---|
| Molecular Weight | 456.09 g/mol |
| LogP | 6.62092 |
| Topological Polar Surface Area | 42.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 456.09497 |
| Heavy Atoms | 30 |
| Complexity | 1195.3994 |
Chemical Identifiers
| CAS Number | 111336-87-9 |
|---|---|
| SMILES | CC1=NN(C2=C1N=C(CC(N2)C3=CC=CC=C3)C4=CC=C(C=C4)Br)C5=CC=CC=C5 |
Product Overview
5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine (CAS 111336-87-9), with molecular formula C25H21BrN4 and molecular weight 456.09 g/mol. IUPAC: 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-7,8-dihydro-6H-pyrazolo[4,5-b][1,4]diazepine.
Chemical Property Profile of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine
Property Insights of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine
The XLogP value of 6.62092 indicates that 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.21 Ų, 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine?
The CAS number of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine is 111336-87-9.
What is the molecular formula of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine?
The molecular formula of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine is C25H21BrN4.
What is the molecular weight of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine?
The molecular weight of 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine is 456.09 g/mol.
Where can I buy 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine?
You can request a quote for 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-bromophenyl)-3-methyl-1,7-diphenyl-6,7-dihydro-2H-pyrazolo[3,4-b][1,4]diazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.