3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-
TL;DR: 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- (CAS 5544-70-7) is a chemical compound with molecular formula C15H11ClN2O and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1,2-diphenylpyrazol-3-one
Also Known As: 3-Chloro-1,2-diphenyl-5-pyrazolone, 5-chloro-1,2-diphenylpyrazol-3-one, 3-Chloro-1,2-diphenyl-3-pyrazolin-5-one, 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-, 1,2-Diphenyl-3-chloro-5-pyrazolon
| Molecular Formula | C15H11ClN2O |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.056 |
| Heavy Atoms | 19 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 5544-70-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=CC(=O)N2C3=CC=CC=C3)Cl |
| InChIKey | DVWNJXRYTFAXBW-UHFFFAOYSA-N |
Product Overview
3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- (CAS 5544-70-7), with molecular formula C15H11ClN2O and molecular weight 270.06 g/mol. IUPAC: 5-chloro-1,2-diphenylpyrazol-3-one.
Chemical Property Profile of 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-
Property Insights of 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-
The XLogP value of 4.0 indicates that 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- has 0 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-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-?
The CAS number of 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- is 5544-70-7.
What is the molecular formula of 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-?
The molecular formula of 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- is C15H11ClN2O.
What is the molecular weight of 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-?
The molecular weight of 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- is 270.06 g/mol.
Where can I buy 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-?
You can request a quote for 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyrazolin-5-one, 3-chloro-1,2-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.