3-(Pyrrolidin-1-ylsulphonyl)aniline
TL;DR: 3-(Pyrrolidin-1-ylsulphonyl)aniline (CAS 91619-38-4) is a chemical compound with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyrrolidin-1-ylsulfonylaniline
Also Known As: 3-(pyrrolidin-1-ylsulfonyl)aniline, 3-(pyrrolidine-1-sulfonyl)aniline, 3-pyrrolidin-1-ylsulfonylaniline, 1-[(3-Aminophenyl)sulfonyl]pyrrolidine, 3-(1-Pyrrolidinylsulfonyl)benzenamine
| Molecular Formula | C10H14N2O2S |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 1.0533 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.0776 |
| Heavy Atoms | 15 |
| Complexity | 450.24512 |
Chemical Identifiers
| CAS Number | 91619-38-4 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)N |
Product Overview
3-(Pyrrolidin-1-ylsulphonyl)aniline (CAS 91619-38-4), with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol. IUPAC: 3-pyrrolidin-1-ylsulfonylaniline.
Chemical Property Profile of 3-(Pyrrolidin-1-ylsulphonyl)aniline
Property Insights of 3-(Pyrrolidin-1-ylsulphonyl)aniline
The XLogP value of 1.0533 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Pyrrolidin-1-ylsulphonyl)aniline. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Pyrrolidin-1-ylsulphonyl)aniline. Following Lipinski's Rule of Five, 3-(Pyrrolidin-1-ylsulphonyl)aniline has 1 hydrogen bond donor(s) and 3 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 3-(Pyrrolidin-1-ylsulphonyl)aniline?
The CAS number of 3-(Pyrrolidin-1-ylsulphonyl)aniline is 91619-38-4.
What is the molecular formula of 3-(Pyrrolidin-1-ylsulphonyl)aniline?
The molecular formula of 3-(Pyrrolidin-1-ylsulphonyl)aniline is C10H14N2O2S.
What is the molecular weight of 3-(Pyrrolidin-1-ylsulphonyl)aniline?
The molecular weight of 3-(Pyrrolidin-1-ylsulphonyl)aniline is 226.08 g/mol.
Where can I buy 3-(Pyrrolidin-1-ylsulphonyl)aniline?
You can request a quote for 3-(Pyrrolidin-1-ylsulphonyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Pyrrolidin-1-ylsulphonyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(Pyrrolidin-1-ylsulphonyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.