Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide
TL;DR: Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide (CAS 52208-11-4) is a chemical compound with molecular formula C11H12BrN3O2S and molecular weight 328.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)ethyl carbamimidothioate;hydrobromide
Also Known As: starbld0022550, Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide, 2-(1,3-Dioxo-2-isoindoline)ethylthiuronium bromide, {[2-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl]sulfanyl}methanimidamide hydrobromide, 2-(1,3-dioxoisoindol-2-yl)ethyl carbamimidothioate;hydrobromide
| Molecular Formula | C11H12BrN3O2S |
|---|---|
| Molecular Weight | 328.98 g/mol |
| LogP | 1.48717 |
| Topological Polar Surface Area | 87.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.98337 |
| Heavy Atoms | 18 |
| Complexity | 471.81662 |
Chemical Identifiers
| CAS Number | 52208-11-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC(=N)N.Br |
Product Overview
Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide (CAS 52208-11-4), with molecular formula C11H12BrN3O2S and molecular weight 328.98 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)ethyl carbamimidothioate;hydrobromide.
Chemical Property Profile of Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide
Property Insights of Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide
The XLogP value of 1.48717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide. The TPSA of 87.25 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide. Following Lipinski's Rule of Five, Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide 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 Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide?
The CAS number of Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide is 52208-11-4.
What is the molecular formula of Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide?
The molecular formula of Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide is C11H12BrN3O2S.
What is the molecular weight of Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide?
The molecular weight of Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide is 328.98 g/mol.
Where can I buy Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide?
You can request a quote for Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-(1,3-dioxo-2-isoindolinyl)ethylthio-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.