Bionet1_000532
TL;DR: Bionet1_000532 (CAS 321553-47-3) is a chemical compound with molecular formula C13H11ClF3N3OS and molecular weight 349.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[(4-chlorophenyl)methylsulfanyl]-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methylidene]hydroxylamine
Also Known As: Bionet1_000532, 5-[(4-chlorobenzyl)sulfanyl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbaldehyde oxime, N-[(5-{[(4-CHLOROPHENYL)METHYL]SULFANYL}-1-METHYL-3-(TRIFLUOROMETHYL)PYRAZOL-4-YL)METHYLIDENE]HYDROXYLAMINE, N-[[5-[(4-chlorophenyl)methylsulfanyl]-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methylidene]hydroxylamine
| Molecular Formula | C13H11ClF3N3OS |
|---|---|
| Molecular Weight | 349.03 g/mol |
| LogP | 4.1927 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.02634 |
| Heavy Atoms | 22 |
| Complexity | 683.07416 |
Chemical Identifiers
| CAS Number | 321553-47-3 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C(F)(F)F)C=NO)SCC2=CC=C(C=C2)Cl |
Product Overview
Bionet1_000532 (CAS 321553-47-3), with molecular formula C13H11ClF3N3OS and molecular weight 349.03 g/mol. IUPAC: N-[[5-[(4-chlorophenyl)methylsulfanyl]-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methylidene]hydroxylamine.
Chemical Property Profile of Bionet1_000532
Property Insights of Bionet1_000532
The XLogP value of 4.1927 indicates that Bionet1_000532 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.41 Ų, Bionet1_000532 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_000532 has 1 hydrogen bond donor(s) and 4 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 Bionet1_000532?
The CAS number of Bionet1_000532 is 321553-47-3.
What is the molecular formula of Bionet1_000532?
The molecular formula of Bionet1_000532 is C13H11ClF3N3OS.
What is the molecular weight of Bionet1_000532?
The molecular weight of Bionet1_000532 is 349.03 g/mol.
Where can I buy Bionet1_000532?
You can request a quote for Bionet1_000532 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000532?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000532 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.