Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-
TL;DR: Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- (CAS 62128-43-2) is a chemical compound with molecular formula C13H13NO and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)-(1-methylpyrrol-3-yl)methanone
Also Known As: (4-methylphenyl)-(1-methylpyrrol-3-yl)methanone, 1-methyl-3-(4-methylbenzoyl)-1H-pyrrole, Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-, (1-methyl-1H-pyrrol-3-yl)(p-tolyl)methanone, (4-Methylphenyl)(1-methyl-1H-pyrrol-3-yl)methanone
| Molecular Formula | C13H13NO |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | 2.56452 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.09972 |
| Heavy Atoms | 15 |
| Complexity | 479.492 |
Chemical Identifiers
| CAS Number | 62128-43-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C2=CN(C=C2)C |
Product Overview
Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- (CAS 62128-43-2), with molecular formula C13H13NO and molecular weight 199.10 g/mol. IUPAC: (4-methylphenyl)-(1-methylpyrrol-3-yl)methanone.
Chemical Property Profile of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-
Property Insights of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-
The XLogP value of 2.56452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-. With a topological polar surface area (TPSA) of 22.0 Ų, Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-?
The CAS number of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- is 62128-43-2.
What is the molecular formula of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-?
The molecular formula of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- is C13H13NO.
What is the molecular weight of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-?
The molecular weight of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- is 199.10 g/mol.
Where can I buy Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-?
You can request a quote for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.