4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide
TL;DR: 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide (CAS 443651-95-4) is a chemical compound with molecular formula C6H9NO2S and molecular weight 159.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide
Also Known As: EINECS 251-695-4, 4-(aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide, Aziridine, 1-(4,5-dihydro-1,1-dioxido-3-thienyl)- (9CI), 3-(aziridin-1-yl)-4,5-dihydrothiophene 1,1-dioxide, Aziridine,1-(4,5-dihydro-1,1-dioxido-3-thienyl)-
| Molecular Formula | C6H9NO2S |
|---|---|
| Molecular Weight | 159.04 g/mol |
| LogP | -0.0381 |
| Topological Polar Surface Area | 37.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.0354 |
| Heavy Atoms | 10 |
| Complexity | 274.12296 |
Chemical Identifiers
| CAS Number | 443651-95-4 |
|---|---|
| SMILES | C1CS(=O)(=O)C=C1N2CC2 |
Product Overview
4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide (CAS 443651-95-4), with molecular formula C6H9NO2S and molecular weight 159.04 g/mol. IUPAC: 4-(aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide.
Chemical Property Profile of 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide
Property Insights of 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide
The XLogP value of -0.0381 indicates that 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 37.15 Ų, 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide has 0 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 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide?
The CAS number of 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide is 443651-95-4.
What is the molecular formula of 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide?
The molecular formula of 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide is C6H9NO2S.
What is the molecular weight of 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide?
The molecular weight of 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide is 159.04 g/mol.
Where can I buy 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide?
You can request a quote for 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 4-(Aziridin-1-yl)-2,3-dihydrothiophene 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.