N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline
TL;DR: N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline (CAS 314765-50-9) is a chemical compound with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)methanimine
Also Known As: N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline, 1-phenyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)methanimine, AN-329/40543582, Benzenamine, N-benzylidene-4-(1-pyrrolidinylsulfonyl)-, N-benzylidene-N-[4-(1-pyrrolidinylsulfonyl)phenyl]amine
| Molecular Formula | C17H18N2O2S |
|---|---|
| Molecular Weight | 314.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.1089 |
| Heavy Atoms | 22 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 314765-50-9 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=CC=CC=C3 |
| InChIKey | GVSVOKFPCDFANF-UHFFFAOYSA-N |
Product Overview
N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline (CAS 314765-50-9), with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol. IUPAC: 1-phenyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)methanimine.
Chemical Property Profile of N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline
Property Insights of N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline. With a topological polar surface area (TPSA) of 58.1 Ų, N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline has 0 hydrogen bond donor(s) and 4 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 N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline?
The CAS number of N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline is 314765-50-9.
What is the molecular formula of N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline?
The molecular formula of N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline is C17H18N2O2S.
What is the molecular weight of N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline?
The molecular weight of N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline is 314.11 g/mol.
Where can I buy N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline?
You can request a quote for N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-benzylidene-4-(1-pyrrolidinylsulfonyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.