Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-
TL;DR: Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl- (CAS 57436-07-4) is a chemical compound with molecular formula C12H12N2O and molecular weight 200.09 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
Also Known As: 4-Amino-3-benzoyl-2-methylpyrrole, starbld0006700, 2-methyl-3-benzoyl-4-aminopyrrole, Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-, 4-Amino-3-benzoyl-2-methyl-1H-pyrrole
| Molecular Formula | C12H12N2O |
|---|---|
| Molecular Weight | 200.09 g/mol |
| LogP | 2.13632 |
| Topological Polar Surface Area | 58.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.09496 |
| Heavy Atoms | 15 |
| Complexity | 466.07816 |
Chemical Identifiers
| CAS Number | 57436-07-4 |
|---|---|
| SMILES | CC1=C(C(=CN1)N)C(=O)C2=CC=CC=C2 |
Product Overview
Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl- (CAS 57436-07-4), with molecular formula C12H12N2O and molecular weight 200.09 g/mol. IUPAC: (4-amino-2-methyl-1H-pyrrol-3-yl)-phenylmethanone.
Chemical Property Profile of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-
Property Insights of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-
The XLogP value of 2.13632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-. With a topological polar surface area (TPSA) of 58.88 Ų, Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl- 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- 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-?
The CAS number of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl- is 57436-07-4.
What is the molecular formula of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-?
The molecular formula of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl- is C12H12N2O.
What is the molecular weight of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-?
The molecular weight of Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl- is 200.09 g/mol.
Where can I buy Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-?
You can request a quote for Methanone, (4-amino-2-methyl-1H-pyrrol-3-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, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (4-amino-2-methyl-1H-pyrrol-3-yl)phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.