3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine
TL;DR: 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine (CAS 33267-71-9) is a chemical compound with molecular formula C15H21ClN2O and molecular weight 280.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)-ethoxymethyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine
Also Known As: 5-23-11-00411 (Beilstein Handbook Reference), 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine, 2-(4-Chloro-alpha-ethoxybenzyl)-5,5-dimethyl-3,4,5,6-tetrahydropyrimidine, 2-(p-Chloro-alpha-ethoxybenzyl)-5,5-dimethyl-3,4,5,6-tetrahydropyrimidine, 3,4,5,6-Tetrahydro-2-(p-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine
| Molecular Formula | C15H21ClN2O |
|---|---|
| Molecular Weight | 280.13 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 33.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.13425 |
| Heavy Atoms | 19 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 33267-71-9 |
|---|---|
| SMILES | CCOC(C1=CC=C(C=C1)Cl)C2=NCC(CN2)(C)C |
| InChIKey | NKZQEKLNOVBFRX-UHFFFAOYSA-N |
Product Overview
3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine (CAS 33267-71-9), with molecular formula C15H21ClN2O and molecular weight 280.13 g/mol. IUPAC: 2-[(4-chlorophenyl)-ethoxymethyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine.
Chemical Property Profile of 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine
Property Insights of 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine
The XLogP value of 3.0 indicates that 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.6 Ų, 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine has 1 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 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine?
The CAS number of 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine is 33267-71-9.
What is the molecular formula of 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine?
The molecular formula of 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine is C15H21ClN2O.
What is the molecular weight of 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine?
The molecular weight of 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine is 280.13 g/mol.
Where can I buy 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine?
You can request a quote for 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.