5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde
TL;DR: 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde (CAS 60484-40-4) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-oxo-2-phenyl-1H-pyrazole-4-carbaldehyde
Also Known As: 5-hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde, L-Alanineamidehydrochloride, ZERO/003370, 5-hydroxy-3-methyl-1-phenylpyrazole-4-carbaldehyde, S-((methylthio)methyl)-D-cysteine
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 60484-40-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=O |
| InChIKey | RWBBDSAYSNJJHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde (CAS 60484-40-4), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: 5-methyl-3-oxo-2-phenyl-1H-pyrazole-4-carbaldehyde.
Chemical Property Profile of 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde
Property Insights of 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde. With a topological polar surface area (TPSA) of 49.4 Ų, 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde 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 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The CAS number of 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde is 60484-40-4.
What is the molecular formula of 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The molecular formula of 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde is C11H10N2O2.
What is the molecular weight of 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The molecular weight of 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde is 202.07 g/mol.
Where can I buy 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
You can request a quote for 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.