1-(2,2,2-Tribromo-1-hydroxyethyl)urea
TL;DR: 1-(2,2,2-Tribromo-1-hydroxyethyl)urea (CAS 20972-54-7) is a chemical compound with molecular formula C3H5Br3N2O2 and molecular weight 337.79 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,2-tribromo-1-hydroxyethyl)urea
Also Known As: Bromalharnstoff, 1-(2,2,2-tribromo-1-hydroxyethyl)urea, (2,2,2-tribromo-1-hydroxyethyl)urea, KST-1B1626, N-(2,2,2-tribromo-1-hydroxyethyl)urea
| Molecular Formula | C3H5Br3N2O2 |
|---|---|
| Molecular Weight | 337.79 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 337.79013 |
| Heavy Atoms | 10 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 20972-54-7 |
|---|---|
| SMILES | C(C(Br)(Br)Br)(NC(=O)N)O |
| InChIKey | GCMCFDQJEVZZRF-UHFFFAOYSA-N |
Product Overview
1-(2,2,2-Tribromo-1-hydroxyethyl)urea (CAS 20972-54-7), with molecular formula C3H5Br3N2O2 and molecular weight 337.79 g/mol. IUPAC: (2,2,2-tribromo-1-hydroxyethyl)urea.
Chemical Property Profile of 1-(2,2,2-Tribromo-1-hydroxyethyl)urea
Property Insights of 1-(2,2,2-Tribromo-1-hydroxyethyl)urea
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,2,2-Tribromo-1-hydroxyethyl)urea. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,2,2-Tribromo-1-hydroxyethyl)urea. Following Lipinski's Rule of Five, 1-(2,2,2-Tribromo-1-hydroxyethyl)urea 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 1-(2,2,2-Tribromo-1-hydroxyethyl)urea?
The CAS number of 1-(2,2,2-Tribromo-1-hydroxyethyl)urea is 20972-54-7.
What is the molecular formula of 1-(2,2,2-Tribromo-1-hydroxyethyl)urea?
The molecular formula of 1-(2,2,2-Tribromo-1-hydroxyethyl)urea is C3H5Br3N2O2.
What is the molecular weight of 1-(2,2,2-Tribromo-1-hydroxyethyl)urea?
The molecular weight of 1-(2,2,2-Tribromo-1-hydroxyethyl)urea is 337.79 g/mol.
Where can I buy 1-(2,2,2-Tribromo-1-hydroxyethyl)urea?
You can request a quote for 1-(2,2,2-Tribromo-1-hydroxyethyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,2,2-Tribromo-1-hydroxyethyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,2,2-Tribromo-1-hydroxyethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.