2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole
TL;DR: 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole (CAS 31396-94-8) is a chemical compound with molecular formula C31H27N and molecular weight 413.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dibenzyl-1-methyl-3,4-diphenylpyrrole
Also Known As: 2,5-dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole, 2,5-dibenzyl-1-methyl-3,4-diphenylpyrrole, 2,5-dibenzyl-1-methyl-3,4-diphenyl-pyrrole, 1H-Pyrrole,1-methyl-3,4-diphenyl-2,5-bis(phenylmethyl)-, RefChem:247261
| Molecular Formula | C31H27N |
|---|---|
| Molecular Weight | 413.21 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 4.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.21436 |
| Heavy Atoms | 32 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 31396-94-8 |
|---|---|
| SMILES | CN1C(=C(C(=C1CC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5 |
| InChIKey | IWSMHEQHUPRYIO-UHFFFAOYSA-N |
Product Overview
2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole (CAS 31396-94-8), with molecular formula C31H27N and molecular weight 413.21 g/mol. IUPAC: 2,5-dibenzyl-1-methyl-3,4-diphenylpyrrole.
Chemical Property Profile of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole
Property Insights of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole
The XLogP value of 7.8 indicates that 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.9 Ų, 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole?
The CAS number of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole is 31396-94-8.
What is the molecular formula of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole?
The molecular formula of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole is C31H27N.
What is the molecular weight of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole?
The molecular weight of 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole is 413.21 g/mol.
Where can I buy 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole?
You can request a quote for 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dibenzyl-1-methyl-3,4-diphenyl-1h-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.