1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine
TL;DR: 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine (CAS 59962-97-9) is a chemical compound with molecular formula C14H19N3O4S and molecular weight 325.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine
Also Known As: 1-(2-methyl-2-propenyl)oxynaphthalene, 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine, 1-{[3-nitro-4-(pyrrolidin-1-yl)phenyl]sulfonyl}pyrrolidine, 1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine, 1-[2-nitro-4-(pyrrolidine-1-sulfonyl)phenyl]pyrrolidine
| Molecular Formula | C14H19N3O4S |
|---|---|
| Molecular Weight | 325.11 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.10962 |
| Heavy Atoms | 22 |
| Complexity | 501.0 |
Chemical Identifiers
| CAS Number | 59962-97-9 |
|---|---|
| SMILES | C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-] |
| InChIKey | FHSGSDILYBYARM-UHFFFAOYSA-N |
Product Overview
1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine (CAS 59962-97-9), with molecular formula C14H19N3O4S and molecular weight 325.11 g/mol. IUPAC: 1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine.
Chemical Property Profile of 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine
Property Insights of 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine. Following Lipinski's Rule of Five, 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine has 0 hydrogen bond donor(s) and 6 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-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine?
The CAS number of 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine is 59962-97-9.
What is the molecular formula of 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine?
The molecular formula of 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine is C14H19N3O4S.
What is the molecular weight of 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine?
The molecular weight of 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine is 325.11 g/mol.
Where can I buy 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine?
You can request a quote for 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-((3-Nitro-4-(pyrrolidin-1-yl)phenyl)sulfonyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.