![{5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone structure](/static/products/866/866149-64-6.png)
{5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone
TL;DR: {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone (CAS 866149-64-6) is a chemical compound with molecular formula C30H31N3O and molecular weight 449.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-[(4-benzhydrylpiperazin-1-yl)methyl]-1-methylpyrrol-3-yl]-phenylmethanone
Also Known As: 9X-0248, {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone, [5-[(4-benzhydrylpiperazin-1-yl)methyl]-1-methylpyrrol-3-yl]-phenylmethanone, [5-[(4-benzhydrylpiperazin-1-yl)methyl]-1-methyl-pyrrol-3-yl]-phenyl-methanone, 1-[(4-benzoyl-1-methyl-1H-pyrrol-2-yl)methyl]-4-(diphenylmethyl)piperazine
| Molecular Formula | C30H31N3O |
|---|---|
| Molecular Weight | 449.25 g/mol |
| LogP | 5.1633 |
| Topological Polar Surface Area | 28.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.2467 |
| Heavy Atoms | 34 |
| Complexity | 1170.4221 |
Chemical Identifiers
| CAS Number | 866149-64-6 |
|---|---|
| SMILES | CN1C=C(C=C1CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5 |
Product Overview
{5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone (CAS 866149-64-6), with molecular formula C30H31N3O and molecular weight 449.25 g/mol. IUPAC: [5-[(4-benzhydrylpiperazin-1-yl)methyl]-1-methylpyrrol-3-yl]-phenylmethanone.
Chemical Property Profile of {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone
Property Insights of {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone
The XLogP value of 5.1633 indicates that {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.48 Ų, {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone has 0 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-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone?
The CAS number of {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone is 866149-64-6.
What is the molecular formula of {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone?
The molecular formula of {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone is C30H31N3O.
What is the molecular weight of {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone?
The molecular weight of {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone is 449.25 g/mol.
Where can I buy {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone?
You can request a quote for {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for {5-[(4-benzhydrylpiperazino)methyl]-1-methyl-1H-pyrrol-3-yl}(phenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.