Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide
TL;DR: Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide (CAS 106976-63-0) is a chemical compound with molecular formula C11H17BrN2O and molecular weight 272.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(1-methylaziridin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one bromide
Also Known As: BR 401 A, 1-Methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)aziridinium bromide, 2,2-DIHYDROPEROXYTETRADECANEDIOIC ACID, AZIRIDINIUM, 1-METHYL-1-(4-(2-OXO-1-PYRROLIDINYL)-2-BUTYNYL)-, BROMIDE, 1-[4-(1-methylaziridin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one bromide
| Molecular Formula | C11H17BrN2O |
|---|---|
| Molecular Weight | 272.05 g/mol |
| LogP | -2.92 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.05243 |
| Heavy Atoms | 15 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 106976-63-0 |
|---|---|
| SMILES | C[N+]1(CC1)CC#CCN2CCCC2=O.[Br-] |
| InChIKey | FGEZSBPYCZHQNH-UHFFFAOYSA-M |
Product Overview
Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide (CAS 106976-63-0), with molecular formula C11H17BrN2O and molecular weight 272.05 g/mol. IUPAC: 1-[4-(1-methylaziridin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one bromide.
Chemical Property Profile of Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide
Property Insights of Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide
The XLogP value of -2.92 indicates that Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.3 Ų, Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide has 0 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 Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide?
The CAS number of Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide is 106976-63-0.
What is the molecular formula of Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide?
The molecular formula of Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide is C11H17BrN2O.
What is the molecular weight of Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide?
The molecular weight of Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide is 272.05 g/mol.
Where can I buy Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide?
You can request a quote for Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Aziridinium, 1-methyl-1-(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.