4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
TL;DR: 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one (CAS 214839-85-7) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-aminopropyl)-5-phenyl-1,2-dihydropyrazol-3-one
Also Known As: 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one, 4-(3-Aminopropyl)-5-phenyl-1H-pyrazol-3(2H)-one, 4-(3-aminopropyl)-5-phenyl-1,2-dihydropyrazol-3-one, 4-(3-Aminopropyl)-5-phenyl-1H-pyrazol-3-ol, 4- (3- Aminopropyl) - 1, 2- dihydro- 5- phenyl-3H- pyrazol- 3- one
| Molecular Formula | C12H15N3O |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 1.2613 |
| Topological Polar Surface Area | 74.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.1215 |
| Heavy Atoms | 16 |
| Complexity | 498.48245 |
Chemical Identifiers
| CAS Number | 214839-85-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=O)NN2)CCCN |
Product Overview
4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one (CAS 214839-85-7), with molecular formula C12H15N3O and molecular weight 217.12 g/mol. IUPAC: 4-(3-aminopropyl)-5-phenyl-1,2-dihydropyrazol-3-one.
Chemical Property Profile of 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Property Insights of 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
The XLogP value of 1.2613 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one. The TPSA of 74.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one. Following Lipinski's Rule of Five, 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one has 3 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 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
The CAS number of 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one is 214839-85-7.
What is the molecular formula of 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
The molecular formula of 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one is C12H15N3O.
What is the molecular weight of 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
The molecular weight of 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one is 217.12 g/mol.
Where can I buy 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
You can request a quote for 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-aminopropyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.