3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-
TL;DR: 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- (CAS 57396-96-0) is a chemical compound with molecular formula C13H17ClN2OSi and molecular weight 280.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-5-methyl-2-phenyl-1-trimethylsilylpyrazol-3-one
Also Known As: 4-chloro-5-methyl-2-phenyl-1-trimethylsilylpyrazol-3-one, 3h-pyrazol-3-one,4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-, 4-Chloro-5-methyl-2-phenyl-1-(trimethylsilyl)-1,2-dihydro-3H-pyrazol-3-one, 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-, 3H-Pyrazol-3-one,4-chloro-1,2-dihydro-5-methyl-2-phenyl-1- -
| Molecular Formula | C13H17ClN2OSi |
|---|---|
| Molecular Weight | 280.08 g/mol |
| LogP | 3.28382 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.07986 |
| Heavy Atoms | 18 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 57396-96-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1[Si](C)(C)C)C2=CC=CC=C2)Cl |
| InChIKey | SFCLFQMWBNURBN-UHFFFAOYSA-N |
Product Overview
3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- (CAS 57396-96-0), with molecular formula C13H17ClN2OSi and molecular weight 280.08 g/mol. IUPAC: 4-chloro-5-methyl-2-phenyl-1-trimethylsilylpyrazol-3-one.
Chemical Property Profile of 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-
Property Insights of 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-
The XLogP value of 3.28382 indicates that 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- 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 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-?
The CAS number of 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- is 57396-96-0.
What is the molecular formula of 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-?
The molecular formula of 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- is C13H17ClN2OSi.
What is the molecular weight of 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-?
The molecular weight of 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- is 280.08 g/mol.
Where can I buy 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-?
You can request a quote for 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Pyrazol-3-one, 4-chloro-1,2-dihydro-5-methyl-2-phenyl-1-(trimethylsilyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.