(1,1-Dioxothiolan-3-yl)methylurea
TL;DR: (1,1-Dioxothiolan-3-yl)methylurea (CAS 55260-96-3) is a chemical compound with molecular formula C6H12N2O3S and molecular weight 192.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,1-dioxothiolan-3-yl)methylurea
Also Known As: (1,1-dioxothiolan-3-yl)methylurea, [(1,1-dioxo-1, E6-thiolan-3-yl)methyl]urea, [(1,1-dioxo-1lambda6-thiolan-3-yl)methyl]urea, 1-((1,1-Dioxidotetrahydrothiophen-3-yl)methyl)urea
| Molecular Formula | C6H12N2O3S |
|---|---|
| Molecular Weight | 192.06 g/mol |
| LogP | -0.9106 |
| Topological Polar Surface Area | 89.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.05687 |
| Heavy Atoms | 12 |
| Complexity | 272.5178 |
Chemical Identifiers
| CAS Number | 55260-96-3 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1CNC(=O)N |
Product Overview
(1,1-Dioxothiolan-3-yl)methylurea (CAS 55260-96-3), with molecular formula C6H12N2O3S and molecular weight 192.06 g/mol. IUPAC: (1,1-dioxothiolan-3-yl)methylurea.
Chemical Property Profile of (1,1-Dioxothiolan-3-yl)methylurea
Property Insights of (1,1-Dioxothiolan-3-yl)methylurea
The XLogP value of -0.9106 indicates that (1,1-Dioxothiolan-3-yl)methylurea 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-Dioxothiolan-3-yl)methylurea. Following Lipinski's Rule of Five, (1,1-Dioxothiolan-3-yl)methylurea 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-Dioxothiolan-3-yl)methylurea?
The CAS number of (1,1-Dioxothiolan-3-yl)methylurea is 55260-96-3.
What is the molecular formula of (1,1-Dioxothiolan-3-yl)methylurea?
The molecular formula of (1,1-Dioxothiolan-3-yl)methylurea is C6H12N2O3S.
What is the molecular weight of (1,1-Dioxothiolan-3-yl)methylurea?
The molecular weight of (1,1-Dioxothiolan-3-yl)methylurea is 192.06 g/mol.
Where can I buy (1,1-Dioxothiolan-3-yl)methylurea?
You can request a quote for (1,1-Dioxothiolan-3-yl)methylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,1-Dioxothiolan-3-yl)methylurea?
Yes, KEHONG BIO provides custom synthesis services for (1,1-Dioxothiolan-3-yl)methylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.