2-Thienylmagnesium bromide solution
TL;DR: 2-Thienylmagnesium bromide solution (CAS 5713-78-0) is a chemical compound with molecular formula C17H20Cl2N2O3 and molecular weight 370.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 6-(3,4-dichlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: 2-Thienylmagnesium bromide solution, BAS 00633868, butyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, butyl 6-(3,4-dichlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate, BUTYL 4-(3,4-DICHLOROPHENYL)-1,6-DIMETHYL-2-OXO-3,4-DIHYDROPYRIMIDINE-5-CARBOXYLATE
| Molecular Formula | C17H20Cl2N2O3 |
|---|---|
| Molecular Weight | 370.09 g/mol |
| LogP | 4.3068 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.08508 |
| Heavy Atoms | 24 |
| Complexity | 688.41327 |
Chemical Identifiers
| CAS Number | 5713-78-0 |
|---|---|
| SMILES | CCCCOC(=O)C1=C(N(C(=O)NC1C2=CC(=C(C=C2)Cl)Cl)C)C |
Product Overview
2-Thienylmagnesium bromide solution (CAS 5713-78-0), with molecular formula C17H20Cl2N2O3 and molecular weight 370.09 g/mol. IUPAC: butyl 6-(3,4-dichlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of 2-Thienylmagnesium bromide solution
Property Insights of 2-Thienylmagnesium bromide solution
The XLogP value of 4.3068 indicates that 2-Thienylmagnesium bromide solution is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, 2-Thienylmagnesium bromide solution exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Thienylmagnesium bromide solution has 1 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 2-Thienylmagnesium bromide solution?
The CAS number of 2-Thienylmagnesium bromide solution is 5713-78-0.
What is the molecular formula of 2-Thienylmagnesium bromide solution?
The molecular formula of 2-Thienylmagnesium bromide solution is C17H20Cl2N2O3.
What is the molecular weight of 2-Thienylmagnesium bromide solution?
The molecular weight of 2-Thienylmagnesium bromide solution is 370.09 g/mol.
Where can I buy 2-Thienylmagnesium bromide solution?
You can request a quote for 2-Thienylmagnesium bromide solution directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thienylmagnesium bromide solution?
Yes, KEHONG BIO provides custom synthesis services for 2-Thienylmagnesium bromide solution and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.