2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-
TL;DR: 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- (CAS 74037-29-9) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-1-phenyl-3-propyl-4H-pyrazole-4-carbaldehyde
Also Known As: 4-Formyl-1-phenyl-3-propyl-2-pyrazolin-5-one, 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-, 1-Phenyl-3-propyl-5-oxo-2-pyrazoline-4-carbaldehyde, 5-oxo-1-phenyl-3-propyl-4H-pyrazole-4-carbaldehyde, 5-Oxo-1-phenyl-3-propyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 2.0044 |
| Topological Polar Surface Area | 49.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 453.74707 |
Chemical Identifiers
| CAS Number | 74037-29-9 |
|---|---|
| SMILES | CCCC1=NN(C(=O)C1C=O)C2=CC=CC=C2 |
Product Overview
2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- (CAS 74037-29-9), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: 5-oxo-1-phenyl-3-propyl-4H-pyrazole-4-carbaldehyde.
Chemical Property Profile of 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-
Property Insights of 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-
The XLogP value of 2.0044 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-. With a topological polar surface area (TPSA) of 49.74 Ų, 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- has 0 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 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-?
The CAS number of 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- is 74037-29-9.
What is the molecular formula of 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-?
The molecular formula of 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- is C13H14N2O2.
What is the molecular weight of 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-?
The molecular weight of 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- is 230.11 g/mol.
Where can I buy 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-?
You can request a quote for 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrazolin-5-one, 4-formyl-1-phenyl-3-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.