1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline
TL;DR: 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline (CAS 58892-68-5) is a chemical compound with molecular formula C36H39N5 and molecular weight 541.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-1,3-bis[(4-phenylpiperazin-1-yl)methyl]indolizine
Also Known As: CDRI 70-529, CDRI-70-529, 1,3-Bis[ methyl]-2-phenylindolizine, 2-phenyl-1,3-bis[(4-phenylpiperazin-1-yl)methyl]indolizine, INDOLIZINE, 1,3-BIS((4-PHENYL-1-PIPERAZINYL)METHYL)-2-PHENYL-
| Molecular Formula | C36H39N5 |
|---|---|
| Molecular Weight | 541.32 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 17.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 541.32056 |
| Heavy Atoms | 41 |
| Complexity | 771.0 |
Chemical Identifiers
| CAS Number | 58892-68-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=C3C=CC=CN3C(=C2C4=CC=CC=C4)CN5CCN(CC5)C6=CC=CC=C6)C7=CC=CC=C7 |
| InChIKey | FTBAFQHFYPBQJB-UHFFFAOYSA-N |
Product Overview
1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline (CAS 58892-68-5), with molecular formula C36H39N5 and molecular weight 541.32 g/mol. IUPAC: 2-phenyl-1,3-bis[(4-phenylpiperazin-1-yl)methyl]indolizine.
Chemical Property Profile of 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline
Property Insights of 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline
The XLogP value of 7.0 indicates that 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.4 Ų, 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline 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 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline?
The CAS number of 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline is 58892-68-5.
What is the molecular formula of 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline?
The molecular formula of 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline is C36H39N5.
What is the molecular weight of 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline?
The molecular weight of 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline is 541.32 g/mol.
Where can I buy 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline?
You can request a quote for 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis-N-phenylpiperazinomethyl-2-phenylpyrrocoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.