1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine
TL;DR: 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine (CAS 40226-76-4) 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.
1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine
Also Known As: 4-(phenylamino)-2,3-dihydro-1lambda6-thiophene-1,1-dione, 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine, SDCCGMLS-0064720.P001, 4-phenylamino-2,3-dihydrothiophene 1,1-dioxide, AB00074646-01
| Molecular Formula | C10H11NO2S |
|---|---|
| Molecular Weight | 209.05 g/mol |
| LogP | 1.7584 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.05106 |
| Heavy Atoms | 14 |
| Complexity | 448.27017 |
Chemical Identifiers
| CAS Number | 40226-76-4 |
|---|---|
| SMILES | C1CS(=O)(=O)C=C1NC2=CC=CC=C2 |
Product Overview
1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine (CAS 40226-76-4), with molecular formula C10H11NO2S and molecular weight 209.05 g/mol. IUPAC: 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine.
Chemical Property Profile of 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine
Property Insights of 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine
The XLogP value of 1.7584 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine. With a topological polar surface area (TPSA) of 46.17 Ų, 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine 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 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine?
The CAS number of 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine is 40226-76-4.
What is the molecular formula of 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine?
The molecular formula of 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine is C10H11NO2S.
What is the molecular weight of 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine?
The molecular weight of 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine is 209.05 g/mol.
Where can I buy 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine?
You can request a quote for 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 1,1-dioxo-N-phenyl-2,3-dihydrothiophen-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.