2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)
TL;DR: 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) (CAS 57259-13-9) is a chemical compound with molecular formula C21H39Br2N5O2S and molecular weight 583.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-5-methylsulfanylpyrimidin-2-amine;dihydrobromide
Also Known As: 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1), 2-Diaethylamino-4,6-di((4')-N-methylpiperidyl)-oxy-5-methylthiopyrimidin dihydrobromid H2O, N,N-Diethyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-5-(methylsulfanyl)pyrimidin-2-amine--hydrogen bromide (1/2), N,N-diethyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-5-methylsulfanylpyrimidin-2-amine dihydrobromide, RefChem:266664
| Molecular Formula | C21H39Br2N5O2S |
|---|---|
| Molecular Weight | 583.12 g/mol |
| LogP | 4.1465 |
| Topological Polar Surface Area | 53.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 583.11914 |
| Heavy Atoms | 31 |
| Complexity | 607.6524 |
Chemical Identifiers
| CAS Number | 57259-13-9 |
|---|---|
| SMILES | CCN(CC)C1=NC(=C(C(=N1)OC2CCN(CC2)C)SC)OC3CCN(CC3)C.Br.Br |
Product Overview
2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) (CAS 57259-13-9), with molecular formula C21H39Br2N5O2S and molecular weight 583.12 g/mol. IUPAC: N,N-diethyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-5-methylsulfanylpyrimidin-2-amine;dihydrobromide.
Chemical Property Profile of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)
Property Insights of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)
The XLogP value of 4.1465 indicates that 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.96 Ų, 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)?
The CAS number of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) is 57259-13-9.
What is the molecular formula of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)?
The molecular formula of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) is C21H39Br2N5O2S.
What is the molecular weight of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)?
The molecular weight of 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) is 583.12 g/mol.
Where can I buy 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)?
You can request a quote for 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrimidinamine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-N,N-diethyl-, hydrobromide, hydrate (1:2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.