![methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate structure](/static/products/621/6212-64-2.png)
methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate
TL;DR: methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate (CAS 6212-64-2) is a chemical compound with molecular formula C17H17N3O7S and molecular weight 407.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate
Also Known As: methyl 3-{[(dimethylamino)methylene]sulfamoyl}-5-nitro-4-phenoxybenzoate
| Molecular Formula | C17H17N3O7S |
|---|---|
| Molecular Weight | 407.08 g/mol |
| LogP | 2.4523 |
| Topological Polar Surface Area | 128.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.07874 |
| Heavy Atoms | 28 |
| Complexity | 1018.5466 |
Chemical Identifiers
| CAS Number | 6212-64-2 |
|---|---|
| SMILES | CN(C)/C=N\S(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)[N+](=O)[O-])C(=O)OC |
Product Overview
methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate (CAS 6212-64-2), with molecular formula C17H17N3O7S and molecular weight 407.08 g/mol. IUPAC: methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate.
Chemical Property Profile of methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate
Property Insights of methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate
The XLogP value of 2.4523 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate. The TPSA of 128.41 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate. Following Lipinski's Rule of Five, methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate 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 methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate?
The CAS number of methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate is 6212-64-2.
What is the molecular formula of methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate?
The molecular formula of methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate is C17H17N3O7S.
What is the molecular weight of methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate?
The molecular weight of methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate is 407.08 g/mol.
Where can I buy methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate?
You can request a quote for methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[(Z)-dimethylaminomethylideneamino]sulfonyl-5-nitro-4-phenoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.