Bionet1_001553
TL;DR: Bionet1_001553 (CAS 338794-72-2) is a chemical compound with molecular formula C16H13Cl2N3O3S and molecular weight 397.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-2-[(5-chlorothiadiazol-4-yl)methoxyiminomethyl]cyclohexane-1,3-dione
Also Known As: Bionet1_001553, 4-(4-Chlorophenyl)-2,6-dioxocyclohexanecarboxaldehyde 1-[O-[(5-chloro-1,2,3-thiadiazol-4-yl)methyl]oxime], 5-(4-chlorophenyl)-2-[(5-chlorothiadiazol-4-yl)methoxyiminomethyl]cyclohexane-1,3-dione
| Molecular Formula | C16H13Cl2N3O3S |
|---|---|
| Molecular Weight | 397.01 g/mol |
| LogP | 3.6793 |
| Topological Polar Surface Area | 81.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.00546 |
| Heavy Atoms | 25 |
| Complexity | 789.2112 |
Chemical Identifiers
| CAS Number | 338794-72-2 |
|---|---|
| SMILES | C1C(CC(=O)C(C1=O)C=NOCC2=C(SN=N2)Cl)C3=CC=C(C=C3)Cl |
Product Overview
Bionet1_001553 (CAS 338794-72-2), with molecular formula C16H13Cl2N3O3S and molecular weight 397.01 g/mol. IUPAC: 5-(4-chlorophenyl)-2-[(5-chlorothiadiazol-4-yl)methoxyiminomethyl]cyclohexane-1,3-dione.
Chemical Property Profile of Bionet1_001553
Property Insights of Bionet1_001553
The XLogP value of 3.6793 indicates that Bionet1_001553 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_001553. Following Lipinski's Rule of Five, Bionet1_001553 has 0 hydrogen bond donor(s) and 7 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_001553?
The CAS number of Bionet1_001553 is 338794-72-2.
What is the molecular formula of Bionet1_001553?
The molecular formula of Bionet1_001553 is C16H13Cl2N3O3S.
What is the molecular weight of Bionet1_001553?
The molecular weight of Bionet1_001553 is 397.01 g/mol.
Where can I buy Bionet1_001553?
You can request a quote for Bionet1_001553 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001553?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001553 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.