Urea, N-(2-mercaptoethyl)-N'-methyl-
TL;DR: Urea, N-(2-mercaptoethyl)-N'-methyl- (CAS 72545-68-7) is a chemical compound with molecular formula C4H10N2OS and molecular weight 134.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(2-sulfanylethyl)urea
Also Known As: N-[2-mercaptoethyl]-N'-methylurea, N-(2-Thioethyl) N'-methyl urea, 1-methyl-3-(2-sulfanylethyl)urea, Urea, N-(2-mercaptoethyl)-N'-methyl-, N-Methyl-N'-(2-sulfanylethyl)urea
| Molecular Formula | C4H10N2OS |
|---|---|
| Molecular Weight | 134.05 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.05139 |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 72545-68-7 |
|---|---|
| SMILES | CNC(=O)NCCS |
| InChIKey | GZFMPEKGONDQFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Urea, N-(2-mercaptoethyl)-N'-methyl- (CAS 72545-68-7), with molecular formula C4H10N2OS and molecular weight 134.05 g/mol. IUPAC: 1-methyl-3-(2-sulfanylethyl)urea.
Chemical Property Profile of Urea, N-(2-mercaptoethyl)-N'-methyl-
Property Insights of Urea, N-(2-mercaptoethyl)-N'-methyl-
The XLogP value of -0.3 indicates that Urea, N-(2-mercaptoethyl)-N'-methyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.1 Ų, Urea, N-(2-mercaptoethyl)-N'-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, N-(2-mercaptoethyl)-N'-methyl- has 3 hydrogen bond donor(s) and 2 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 Urea, N-(2-mercaptoethyl)-N'-methyl-?
The CAS number of Urea, N-(2-mercaptoethyl)-N'-methyl- is 72545-68-7.
What is the molecular formula of Urea, N-(2-mercaptoethyl)-N'-methyl-?
The molecular formula of Urea, N-(2-mercaptoethyl)-N'-methyl- is C4H10N2OS.
What is the molecular weight of Urea, N-(2-mercaptoethyl)-N'-methyl-?
The molecular weight of Urea, N-(2-mercaptoethyl)-N'-methyl- is 134.05 g/mol.
Where can I buy Urea, N-(2-mercaptoethyl)-N'-methyl-?
You can request a quote for Urea, N-(2-mercaptoethyl)-N'-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-(2-mercaptoethyl)-N'-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(2-mercaptoethyl)-N'-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.