1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride
TL;DR: 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride (CAS 2905-25-1) is a chemical compound with molecular formula C10H12ClN3O and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-aminophenyl)-5-methyl-4H-pyrazol-3-one;hydrochloride
Also Known As: 2-(3-Aminophenyl)-5-methyl-2,4-dihydro-pyrazol-3-one hydrochloride, 2-Bromobenzenesulfonyl chloride, 2-(3-Amino-phenyl)-5-methyl-2,4-dihydro-pyrazol-3-one HYDROCHLORIDE, 2-(3-aminophenyl)-5-methyl-4H-pyrazol-3-one;hydrochloride, 1-(3-Aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride
| Molecular Formula | C10H12ClN3O |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 1.8032 |
| Topological Polar Surface Area | 58.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.0669 |
| Heavy Atoms | 15 |
| Complexity | 416.88345 |
Chemical Identifiers
| CAS Number | 2905-25-1 |
|---|---|
| SMILES | CC1=NN(C(=O)C1)C2=CC=CC(=C2)N.Cl |
Product Overview
1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride (CAS 2905-25-1), with molecular formula C10H12ClN3O and molecular weight 225.07 g/mol. IUPAC: 2-(3-aminophenyl)-5-methyl-4H-pyrazol-3-one;hydrochloride.
Chemical Property Profile of 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride
Property Insights of 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride
The XLogP value of 1.8032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride. With a topological polar surface area (TPSA) of 58.69 Ų, 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride has 1 hydrogen bond donor(s) and 3 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 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride?
The CAS number of 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride is 2905-25-1.
What is the molecular formula of 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride?
The molecular formula of 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride is C10H12ClN3O.
What is the molecular weight of 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride?
The molecular weight of 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride is 225.07 g/mol.
Where can I buy 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride?
You can request a quote for 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.