Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide
TL;DR: Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide (CAS 18129-31-2) is a chemical compound with molecular formula C6H17Br2N3S and molecular weight 320.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[amino(azaniumylidene)methyl]sulfanylethyl-trimethylazanium dibromide
Also Known As: 2-Trimethylaminoethylisothiuronium bromide hydrobromide, (2-(Amidinothio)ethyl)trimethylammonium bromide hydrobromide, AMMONIUM, (2-(AMIDINOTHIO)ETHYL)TRIMETHYL-, BROMIDE, MONOHYDROBROMIDE, 2-[amino(azaniumylidene)methyl]sulfanylethyl-trimethylazanium dibromide, Ethanaminium, 2-((aminoiminomethyl)thio)-N,N,N-trimethyl-, bromide, monohydrobromide
| Molecular Formula | C6H17Br2N3S |
|---|---|
| Molecular Weight | 320.95 g/mol |
| LogP | -7.49 |
| Topological Polar Surface Area | 76.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.94894 |
| Heavy Atoms | 12 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 18129-31-2 |
|---|---|
| SMILES | C[N+](C)(C)CCSC(=[NH2+])N.[Br-].[Br-] |
| InChIKey | DRCFNKMWMBPEJV-UHFFFAOYSA-M |
Product Overview
Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide (CAS 18129-31-2), with molecular formula C6H17Br2N3S and molecular weight 320.95 g/mol. IUPAC: 2-[amino(azaniumylidene)methyl]sulfanylethyl-trimethylazanium dibromide.
Chemical Property Profile of Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide
Property Insights of Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide
The XLogP value of -7.49 indicates that Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide. Following Lipinski's Rule of Five, Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide has 2 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 Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide?
The CAS number of Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide is 18129-31-2.
What is the molecular formula of Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide?
The molecular formula of Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide is C6H17Br2N3S.
What is the molecular weight of Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide?
The molecular weight of Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide is 320.95 g/mol.
Where can I buy Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide?
You can request a quote for Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (2-(amidinothio)ethyl)trimethyl-, bromide, monohydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.