Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-
TL;DR: Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- (CAS 37496-06-3) is a chemical compound with molecular formula C12H11NO and molecular weight 185.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylpyrrol-2-yl)-phenylmethanone
Also Known As: (1-methyl-1H-pyrrol-2-yl)(phenyl)methanone, Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-, (1-METHYL-PYRROL-2-YL)(PHENYL)METHANONE, 2-benzoyl-1-methyl-1H-pyrrole, (1-methylpyrrol-2-yl)-phenylmethanone
| Molecular Formula | C12H11NO |
|---|---|
| Molecular Weight | 185.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.08406 |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 37496-06-3 |
|---|---|
| SMILES | CN1C=CC=C1C(=O)C2=CC=CC=C2 |
| InChIKey | YLDDGZQCRPTKIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- (CAS 37496-06-3), with molecular formula C12H11NO and molecular weight 185.08 g/mol. IUPAC: (1-methylpyrrol-2-yl)-phenylmethanone.
Chemical Property Profile of Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-
Property Insights of Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-. With a topological polar surface area (TPSA) of 22.0 Ų, Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- 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, (1-methyl-1H-pyrrol-2-yl)phenyl-?
The CAS number of Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- is 37496-06-3.
What is the molecular formula of Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-?
The molecular formula of Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- is C12H11NO.
What is the molecular weight of Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-?
The molecular weight of Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- is 185.08 g/mol.
Where can I buy Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-?
You can request a quote for Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (1-methyl-1H-pyrrol-2-yl)phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.