Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride
TL;DR: Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride (CAS 56463-58-2) is a chemical compound with molecular formula C12H13ClN2O and molecular weight 236.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-2-methyl-1H-pyrrol-3-yl)-phenylmethanone;hydrochloride
Also Known As: (4-Amino-2-methyl-1H-pyrrol-3-yl)phenylmethanone hydrochloride, Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride, Ketone, (4-amino-2-methylpyrrol-3-yl) phenyl, monohydrochloride, 4-Amino-3-benzoyl-2-methylpyrrole hydrochloride, (4-amino-2-methyl-1H-pyrrol-3-yl)-phenylmethanone hydrochloride
| Molecular Formula | C12H13ClN2O |
|---|---|
| Molecular Weight | 236.07 g/mol |
| LogP | 2.55812 |
| Topological Polar Surface Area | 58.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.07164 |
| Heavy Atoms | 16 |
| Complexity | 471.4748 |
Chemical Identifiers
| CAS Number | 56463-58-2 |
|---|---|
| SMILES | CC1=C(C(=CN1)N)C(=O)C2=CC=CC=C2.Cl |
Product Overview
Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride (CAS 56463-58-2), with molecular formula C12H13ClN2O and molecular weight 236.07 g/mol. IUPAC: (4-amino-2-methyl-1H-pyrrol-3-yl)-phenylmethanone;hydrochloride.
Chemical Property Profile of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride
Property Insights of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride
The XLogP value of 2.55812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride. With a topological polar surface area (TPSA) of 58.88 Ų, Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride has 2 hydrogen bond donor(s) and 2 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-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride?
The CAS number of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride is 56463-58-2.
What is the molecular formula of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride?
The molecular formula of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride is C12H13ClN2O.
What is the molecular weight of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride?
The molecular weight of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride is 236.07 g/mol.
Where can I buy Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride?
You can request a quote for Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.