O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid
TL;DR: O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid (CAS 6378-40-1) is a chemical compound with molecular formula C21H20N2O4S and molecular weight 396.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid, 5-[[4-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 4,4-Dimethyl-1,3-diphenyl-1,4,5,6-tetrahydropyrano(2,3-c)pyrazol-6-yl isopropyl ether, 5-({4-[2-(2,5-Dimethylphenoxy)ethoxy]phenyl}methylidene)-4,6-dihydroxypyrimidine-2(5H)-thione, 5-{4-[2-(2,5-dimethylphenoxy)ethoxy]benzylidene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
| Molecular Formula | C21H20N2O4S |
|---|---|
| Molecular Weight | 396.11 g/mol |
| LogP | 2.67554 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.11438 |
| Heavy Atoms | 28 |
| Complexity | 929.378 |
Chemical Identifiers
| CAS Number | 6378-40-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)OCCOC2=CC=C(C=C2)C=C3C(=O)NC(=S)NC3=O |
Product Overview
O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid (CAS 6378-40-1), with molecular formula C21H20N2O4S and molecular weight 396.11 g/mol. IUPAC: 5-[[4-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid
Property Insights of O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid
The XLogP value of 2.67554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid. Following Lipinski's Rule of Five, O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid has 2 hydrogen bond donor(s) and 5 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 O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid?
The CAS number of O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid is 6378-40-1.
What is the molecular formula of O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid?
The molecular formula of O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid is C21H20N2O4S.
What is the molecular weight of O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid?
The molecular weight of O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid is 396.11 g/mol.
Where can I buy O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid?
You can request a quote for O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid?
Yes, KEHONG BIO provides custom synthesis services for O-Benzoyl-4-chlor-3-nitro-benzhydroxamoylchlorid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.