3-(4-Aminophenyl)-4-sulfolene
TL;DR: 3-(4-Aminophenyl)-4-sulfolene (CAS 57465-39-1) is a chemical compound with molecular formula C10H11NO2S and molecular weight 209.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,1-dioxo-2,3-dihydrothiophen-3-yl)aniline
Also Known As: 3-(4-aminophenyl)-4-sulfolene, 4-(1,1-dioxido-2,3-dihydro-3-thienyl)aniline, 4-(1,1-dioxo-2,3-dihydrothiophen-3-yl)aniline, 4-(1,1-Dioxo-2,3-dihydro-1H-1lambda6-thiophen-3-yl)phenylamine
| Molecular Formula | C10H11NO2S |
|---|---|
| Molecular Weight | 209.05 g/mol |
| LogP | 1.2945 |
| Topological Polar Surface Area | 60.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.05106 |
| Heavy Atoms | 14 |
| Complexity | 459.4003 |
Chemical Identifiers
| CAS Number | 57465-39-1 |
|---|---|
| SMILES | C1C(C=CS1(=O)=O)C2=CC=C(C=C2)N |
Product Overview
3-(4-Aminophenyl)-4-sulfolene (CAS 57465-39-1), with molecular formula C10H11NO2S and molecular weight 209.05 g/mol. IUPAC: 4-(1,1-dioxo-2,3-dihydrothiophen-3-yl)aniline.
Chemical Property Profile of 3-(4-Aminophenyl)-4-sulfolene
Property Insights of 3-(4-Aminophenyl)-4-sulfolene
The XLogP value of 1.2945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Aminophenyl)-4-sulfolene. The TPSA of 60.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Aminophenyl)-4-sulfolene. Following Lipinski's Rule of Five, 3-(4-Aminophenyl)-4-sulfolene 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-(4-Aminophenyl)-4-sulfolene?
The CAS number of 3-(4-Aminophenyl)-4-sulfolene is 57465-39-1.
What is the molecular formula of 3-(4-Aminophenyl)-4-sulfolene?
The molecular formula of 3-(4-Aminophenyl)-4-sulfolene is C10H11NO2S.
What is the molecular weight of 3-(4-Aminophenyl)-4-sulfolene?
The molecular weight of 3-(4-Aminophenyl)-4-sulfolene is 209.05 g/mol.
Where can I buy 3-(4-Aminophenyl)-4-sulfolene?
You can request a quote for 3-(4-Aminophenyl)-4-sulfolene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Aminophenyl)-4-sulfolene?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Aminophenyl)-4-sulfolene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.