RefChem:1051416
TL;DR: RefChem:1051416 (CAS 145071-46-1) is a chemical compound with molecular formula C14H15BrN2O3 and molecular weight 338.0266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-bromophenyl) 5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridine-1-carboxylate
Also Known As: 4-Bromophenyl (E)-3,6-dihydro-5-((methoxyimino)methyl)-1(2H)-pyridinecarboxylate, 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 4-bromophenyl ester, (E)-, 1,2,5,6-Tetrahydro-3-methoxyiminomethyl-1-pyridinecarboxylic acid 4-bromophenyl ester, 4-bromophenyl 5-[(methoxyimino)methyl]-1,2,3,6-tetrahydropyridine-1-carboxylate, BRN 5822163
Technical Specifications
| Molecular Formula | C14H15BrN2O3 |
| Molecular Weight | 338.0266 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.0266 Da |
| Heavy Atoms | 20 |
| Complexity | 390.0 |
| SMILES | CO/N=C/C1=CCCN(C1)C(=O)OC2=CC=C(C=C2)Br |
| InChIKey | MHBMDVMWOYBAFW-CXUHLZMHSA-N |
Chemical Property Profile of RefChem:1051416
Property Insights of RefChem:1051416
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1051416. With a topological polar surface area (TPSA) of 51.1 Ų, RefChem:1051416 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1051416 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1051416?
The CAS number of RefChem:1051416 is 145071-46-1.
What is the molecular formula of RefChem:1051416?
The molecular formula of RefChem:1051416 is C14H15BrN2O3.
What is the molecular weight of RefChem:1051416?
The molecular weight of RefChem:1051416 is 338.0266 g/mol.
Where can I buy RefChem:1051416?
You can request a quote for RefChem:1051416 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1051416?
Yes, CoreyChem provides custom synthesis services for RefChem:1051416 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.