![4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide structure](/static/products/588/588679-62-3.png)
4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide
TL;DR: 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide (CAS 588679-62-3) is a chemical compound with molecular formula C18H19N3O6S and molecular weight 405.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methylpropyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzenesulfonamide
Also Known As: 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide, [(1E)-2-(6-nitro(2H-benzo[d]1,3-dioxolan-5-yl))-1-azavinyl]{[4-(2-methylpropyl )phenyl]sulfonyl}amine, 4-(2-methylpropyl)-N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]benzenesulfonohydrazide, 4-(2-methylpropyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzenesulfonamide
| Molecular Formula | C18H19N3O6S |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 2.8344 |
| Topological Polar Surface Area | 120.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 405.09946 |
| Heavy Atoms | 28 |
| Complexity | 1016.36163 |
Chemical Identifiers
| CAS Number | 588679-62-3 |
|---|---|
| SMILES | CC(C)CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3 |
Product Overview
4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide (CAS 588679-62-3), with molecular formula C18H19N3O6S and molecular weight 405.10 g/mol. IUPAC: 4-(2-methylpropyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzenesulfonamide.
Chemical Property Profile of 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide
Property Insights of 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide
The XLogP value of 2.8344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide. The TPSA of 120.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide. Following Lipinski's Rule of Five, 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide has 1 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 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide?
The CAS number of 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide is 588679-62-3.
What is the molecular formula of 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide?
The molecular formula of 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide is C18H19N3O6S.
What is the molecular weight of 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide?
The molecular weight of 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide is 405.10 g/mol.
Where can I buy 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide?
You can request a quote for 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-methylpropyl)-N-[(6-nitrobenzo[1,3]dioxol-5-yl)methylideneamino]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.