RefChem:1051414
TL;DR: RefChem:1051414 (CAS 145071-50-7) is a chemical compound with molecular formula C22H32N2O3 and molecular weight 372.2413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2,4,4-trimethylpentan-2-yl)phenyl] 5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridine-1-carboxylate
Also Known As: 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 4-(1,1,3,3-tetramethylbutyl)phenyl ester, (E)-, 1,2,5,6-Tetrahydro-3-methoxyiminomethyl-1-pyridinecarboxylic acid 4-(1,1,3,3-tetramethylbutyl)phenyl ester, 4-(2,4,4-trimethylpentan-2-yl)phenyl 5-[(methoxyimino)methyl]-1,2,3,6-tetrahydropyridine-1-carboxylate, BRN 5832568
Technical Specifications
| Molecular Formula | C22H32N2O3 |
| Molecular Weight | 372.2413 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 372.2413 Da |
| Heavy Atoms | 27 |
| Complexity | 552.0 |
| SMILES | CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OC(=O)N2CCC=C(C2)/C=N/OC |
| InChIKey | WPQXULDASWLEAH-OEAKJJBVSA-N |
Chemical Property Profile of RefChem:1051414
Property Insights of RefChem:1051414
The XLogP value of 5.5 indicates that RefChem:1051414 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, RefChem:1051414 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1051414 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1051414?
The CAS number of RefChem:1051414 is 145071-50-7.
What is the molecular formula of RefChem:1051414?
The molecular formula of RefChem:1051414 is C22H32N2O3.
What is the molecular weight of RefChem:1051414?
The molecular weight of RefChem:1051414 is 372.2413 g/mol.
Where can I buy RefChem:1051414?
You can request a quote for RefChem:1051414 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1051414?
Yes, CoreyChem provides custom synthesis services for RefChem:1051414 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.