1,1-dimethyl-3-(2H-tetrazol-5-yl)urea
TL;DR: 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea (CAS 125708-95-4) is a chemical compound with molecular formula C4H8N6O and molecular weight 156.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethyl-3-(2H-tetrazol-5-yl)urea
Also Known As: 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea, 1,1-Dimethyl-3-(1H-tetrazol-5-yl)-urea, N',N'-Dimethyl-N-(tetrazol-5-yl) urea, 1,1-dimethyl-3-(1H-tetrazol-5-yl)urea, N,N-Dimethyl-N'-(1H-tetraazol-5-yl)urea #
| Molecular Formula | C4H8N6O |
|---|---|
| Molecular Weight | 156.08 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 86.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.07596 |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 125708-95-4 |
|---|---|
| SMILES | CN(C)C(=O)NC1=NNN=N1 |
| InChIKey | XWLUWDHOTAFTBP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-dimethyl-3-(2H-tetrazol-5-yl)urea (CAS 125708-95-4), with molecular formula C4H8N6O and molecular weight 156.08 g/mol. IUPAC: 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea.
Chemical Property Profile of 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea
Property Insights of 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea
The XLogP value of -1.0 indicates that 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea. Following Lipinski's Rule of Five, 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea has 2 hydrogen bond donor(s) and 4 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-dimethyl-3-(2H-tetrazol-5-yl)urea?
The CAS number of 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea is 125708-95-4.
What is the molecular formula of 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea?
The molecular formula of 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea is C4H8N6O.
What is the molecular weight of 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea?
The molecular weight of 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea is 156.08 g/mol.
Where can I buy 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea?
You can request a quote for 1,1-dimethyl-3-(2H-tetrazol-5-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-dimethyl-3-(2H-tetrazol-5-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1,1-dimethyl-3-(2H-tetrazol-5-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.