3-anilino-2-methyl-1H-pyrazol-5-one
TL;DR: 3-anilino-2-methyl-1H-pyrazol-5-one (CAS 1005952-86-2) is a chemical compound with molecular formula C10H11N3O and molecular weight 189.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-anilino-2-methyl-1H-pyrazol-5-one
Also Known As: Maybridge1_004144, 3-anilino-2-methyl-1H-pyrazol-5-one, 1-Methyl-5-phenylamino-1H-pyrazol-3-ol, 1-Methyl-5-(phenylamino)-1H-pyrazol-3-ol, 1-methyl-5-(phenylamino)-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C10H11N3O |
|---|---|
| Molecular Weight | 189.09 g/mol |
| LogP | 1.457 |
| Topological Polar Surface Area | 49.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.09021 |
| Heavy Atoms | 14 |
| Complexity | 469.61237 |
Chemical Identifiers
| CAS Number | 1005952-86-2 |
|---|---|
| SMILES | CN1C(=CC(=O)N1)NC2=CC=CC=C2 |
Product Overview
3-anilino-2-methyl-1H-pyrazol-5-one (CAS 1005952-86-2), with molecular formula C10H11N3O and molecular weight 189.09 g/mol. IUPAC: 3-anilino-2-methyl-1H-pyrazol-5-one.
Chemical Property Profile of 3-anilino-2-methyl-1H-pyrazol-5-one
Property Insights of 3-anilino-2-methyl-1H-pyrazol-5-one
The XLogP value of 1.457 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-anilino-2-methyl-1H-pyrazol-5-one. With a topological polar surface area (TPSA) of 49.82 Ų, 3-anilino-2-methyl-1H-pyrazol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-anilino-2-methyl-1H-pyrazol-5-one 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 3-anilino-2-methyl-1H-pyrazol-5-one?
The CAS number of 3-anilino-2-methyl-1H-pyrazol-5-one is 1005952-86-2.
What is the molecular formula of 3-anilino-2-methyl-1H-pyrazol-5-one?
The molecular formula of 3-anilino-2-methyl-1H-pyrazol-5-one is C10H11N3O.
What is the molecular weight of 3-anilino-2-methyl-1H-pyrazol-5-one?
The molecular weight of 3-anilino-2-methyl-1H-pyrazol-5-one is 189.09 g/mol.
Where can I buy 3-anilino-2-methyl-1H-pyrazol-5-one?
You can request a quote for 3-anilino-2-methyl-1H-pyrazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-anilino-2-methyl-1H-pyrazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 3-anilino-2-methyl-1H-pyrazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.