RefChem:341196
TL;DR: RefChem:341196 (CAS 91481-27-5) is a chemical compound with molecular formula C13H14BrClN2O and molecular weight 327.9978 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-acetyl-2-(3-bromophenyl)-5-methyl-1H-pyrrol-3-yl]azanium chloride
Also Known As: Ethanone, 1-(4-amino-5-(3-bromophenyl)-2-methyl-1H-pyrrol-3-yl)-, monohydrochloride, 1-(4-Amino-5-(3-bromophenyl)-2-methyl-1H-pyrrol-3-yl)ethanone hydrochloride, [4-acetyl-2-(3-bromophenyl)-5-methyl-1H-pyrrol-3-yl]azanium chloride, Ketone, (4-amino-5-(m-bromophenyl)-2-methylpyrrol-3-yl) methyl, monohydrochloride
Technical Specifications
| Molecular Formula | C13H14BrClN2O |
| Molecular Weight | 327.9978 g/mol |
| XLogP | -0.17 |
| Topological Polar Surface Area (TPSA) | 60.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.9978 Da |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
| SMILES | CC1=C(C(=C(N1)C2=CC(=CC=C2)Br)[NH3+])C(=O)C.[Cl-] |
| InChIKey | SCOKYTBAKODLEQ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:341196
Property Insights of RefChem:341196
The XLogP value of -0.17 indicates that RefChem:341196 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:341196. Following Lipinski's Rule of Five, RefChem:341196 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
What is the CAS number of RefChem:341196?
The CAS number of RefChem:341196 is 91481-27-5.
What is the molecular formula of RefChem:341196?
The molecular formula of RefChem:341196 is C13H14BrClN2O.
What is the molecular weight of RefChem:341196?
The molecular weight of RefChem:341196 is 327.9978 g/mol.
Where can I buy RefChem:341196?
You can request a quote for RefChem:341196 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:341196?
Yes, CoreyChem provides custom synthesis services for RefChem:341196 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.