Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-
TL;DR: Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)- (CAS 1185001-74-4) is a chemical compound with molecular formula C13H13NO and molecular weight 199.09972 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methylphenyl)-(1-methylpyrrol-2-yl)methanone
Also Known As: (4-methylphenyl)-(1-methylpyrrol-2-yl)methanone, 1-Methyl-d3-2-(4-methylbenzoyl)pyrrole, 1-Methyl-2-(4-methylbenzoyl)-1H-pyrrole, Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-, (1-methyl-1H-pyrrol-2-yl)(p-tolyl)methanone
Technical Specifications
| Molecular Formula | C13H13NO |
| Molecular Weight | 199.09972 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.09972 Da |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
| SMILES | CC1=CC=C(C=C1)C(=O)C2=CC=CN2C |
| InChIKey | WKUBFPPJDMDEFL-UHFFFAOYSA-N |
Chemical Property Profile of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-
Property Insights of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-. With a topological polar surface area (TPSA) of 22.0 Ų, Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-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
What is the CAS number of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-?
The CAS number of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)- is 1185001-74-4.
What is the molecular formula of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-?
The molecular formula of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)- is C13H13NO.
What is the molecular weight of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-?
The molecular weight of Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)- is 199.09972 g/mol.
Where can I buy Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-?
You can request a quote for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)-?
Yes, CoreyChem provides custom synthesis services for Methanone, (4-methylphenyl)(1-methyl-1H-pyrrol-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.