1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea
TL;DR: 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea (CAS 40226-94-6) is a chemical compound with molecular formula C5H8N2O3S and molecular weight 176.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,1-dioxo-2,3-dihydrothiophen-3-yl)urea
Also Known As: 1-(1,1-dioxido-2,3-dihydrothiophen-3-yl)urea, SDCCGMLS-0064710.P001, (1,1-dioxo-2,3-dihydrothiophen-3-yl)urea
| Molecular Formula | C5H8N2O3S |
|---|---|
| Molecular Weight | 176.03 g/mol |
| LogP | -1.0346 |
| Topological Polar Surface Area | 89.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.02556 |
| Heavy Atoms | 11 |
| Complexity | 292.8494 |
Chemical Identifiers
| CAS Number | 40226-94-6 |
|---|---|
| SMILES | C1C(C=CS1(=O)=O)NC(=O)N |
Product Overview
1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea (CAS 40226-94-6), with molecular formula C5H8N2O3S and molecular weight 176.03 g/mol. IUPAC: (1,1-dioxo-2,3-dihydrothiophen-3-yl)urea.
Chemical Property Profile of 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea
Property Insights of 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea
The XLogP value of -1.0346 indicates that 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea. Following Lipinski's Rule of Five, 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea has 2 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-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea?
The CAS number of 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea is 40226-94-6.
What is the molecular formula of 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea?
The molecular formula of 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea is C5H8N2O3S.
What is the molecular weight of 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea?
The molecular weight of 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea is 176.03 g/mol.
Where can I buy 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea?
You can request a quote for 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,1-Dioxido-2,3-dihydrothiophen-3-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.