1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine
TL;DR: 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine (CAS 14937-71-4) is a chemical compound with molecular formula C20H22N4O6S and molecular weight 446.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine
Also Known As: KST-1B0569, BAS 00448208, 1,1'-[sulfonylbis(2-nitrobenzene-4,1-diyl)]dipyrrolidine, 1,1'-(sulfonylbis(2-nitro-4,1-phenylene))dipyrrolidine, 1,1'-[Sulfonylbis(2-nitro-4,1-phenylene)]dipyrrolidine
| Molecular Formula | C20H22N4O6S |
|---|---|
| Molecular Weight | 446.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.126 |
| Heavy Atoms | 31 |
| Complexity | 706.0 |
Chemical Identifiers
| CAS Number | 14937-71-4 |
|---|---|
| SMILES | C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | ZBWLNBBUUFUSRS-UHFFFAOYSA-N |
Product Overview
1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine (CAS 14937-71-4), with molecular formula C20H22N4O6S and molecular weight 446.13 g/mol. IUPAC: 1-[2-nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine.
Chemical Property Profile of 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine
Property Insights of 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine
The XLogP value of 3.6 indicates that 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine has 0 hydrogen bond donor(s) and 8 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 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine?
The CAS number of 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine is 14937-71-4.
What is the molecular formula of 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine?
The molecular formula of 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine is C20H22N4O6S.
What is the molecular weight of 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine?
The molecular weight of 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine is 446.13 g/mol.
Where can I buy 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine?
You can request a quote for 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-Nitro-4-(3-nitro-4-pyrrolidin-1-ylphenyl)sulfonylphenyl]pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.