Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide
TL;DR: Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide (CAS 1704-03-6) is a chemical compound with molecular formula C5H15Br2N3S and molecular weight 306.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethyl N'-ethylcarbamimidothioate;dihydrobromide
Also Known As: 1-Ethyl-2-(2-aminoethyl)isothiouronium dibromide, Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide, Carbamimidothioic acid, ethyl-, 2-aminoethyl ester, dihydrobromide, 2-aminoethyl N'-ethylcarbamimidothioate dihydrobromide, RefChem:375731
| Molecular Formula | C5H15Br2N3S |
|---|---|
| Molecular Weight | 306.94 g/mol |
| LogP | 1.17 |
| Topological Polar Surface Area | 89.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.9333 |
| Heavy Atoms | 11 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 1704-03-6 |
|---|---|
| SMILES | CCN=C(N)SCCN.Br.Br |
| InChIKey | HETKPDLDBOPSJP-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide (CAS 1704-03-6), with molecular formula C5H15Br2N3S and molecular weight 306.94 g/mol. IUPAC: 2-aminoethyl N'-ethylcarbamimidothioate;dihydrobromide.
Chemical Property Profile of Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide
Property Insights of Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide
The XLogP value of 1.17 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide. Following Lipinski's Rule of Five, Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide has 4 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 Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide?
The CAS number of Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide is 1704-03-6.
What is the molecular formula of Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide?
The molecular formula of Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide is C5H15Br2N3S.
What is the molecular weight of Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide?
The molecular weight of Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide is 306.94 g/mol.
Where can I buy Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide?
You can request a quote for Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-(2-aminoethyl)-1-ethyl-2-thio-, dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.