Preparyl
TL;DR: Preparyl (CAS 8061-70-9) is a chemical compound with molecular formula C49H69BrN4O3 and molecular weight 840.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4,4-diphenylbutan-2-amine;4,4-diphenylbutan-2-yl-ethyl-dimethylazanium;5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione;bromide
Also Known As: Preparyl, Amobarbital mixture with Cetiprin and Recipavrin, N,N-dimethyl-4,4-diphenylbutan-2-amine;4,4-diphenylbutan-2-yl-ethyl-dimethylazanium;5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione;bromide, Benzenepropanaminium, N-ethyl-N,N,alpha-trimethyl-gamma-phenyl-, bromide, mixt. with 5-ethyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione and N,N,alpha-trimethyl-gamma-phenylbenzenepropanamine, N,N-dimethyl-4,4-diphenylbutan-2-amine; 4,4-diphenylbutan-2-yl-ethyl-dimethylazanium; 5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione; bromide
| Molecular Formula | C49H69BrN4O3 |
|---|---|
| Molecular Weight | 840.46 g/mol |
| LogP | 7.0411 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 840.4553 |
| Heavy Atoms | 57 |
| Complexity | 787.0 |
Chemical Identifiers
| CAS Number | 8061-70-9 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)NC1=O)CCC(C)C.CC[N+](C)(C)C(C)CC(C1=CC=CC=C1)C2=CC=CC=C2.CC(CC(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C.[Br-] |
| InChIKey | MCULEIOOPLYWOI-UHFFFAOYSA-M |
Product Overview
Preparyl (CAS 8061-70-9), with molecular formula C49H69BrN4O3 and molecular weight 840.46 g/mol. IUPAC: N,N-dimethyl-4,4-diphenylbutan-2-amine;4,4-diphenylbutan-2-yl-ethyl-dimethylazanium;5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione;bromide.
Chemical Property Profile of Preparyl
Property Insights of Preparyl
The XLogP value of 7.0411 indicates that Preparyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Preparyl. Following Lipinski's Rule of Five, Preparyl has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Preparyl?
The CAS number of Preparyl is 8061-70-9.
What is the molecular formula of Preparyl?
The molecular formula of Preparyl is C49H69BrN4O3.
What is the molecular weight of Preparyl?
The molecular weight of Preparyl is 840.46 g/mol.
Where can I buy Preparyl?
You can request a quote for Preparyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Preparyl?
Yes, KEHONG BIO provides custom synthesis services for Preparyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.