Opera_ID_1022
TL;DR: Opera_ID_1022 (CAS 1049751-86-1) is a chemical compound with molecular formula C15H15BrClNO4 and molecular weight 386.9873 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 5-bromo-1-[2-(4-hydroxyphenyl)ethyl]-6-oxopyridine-3-carboxylate;hydrochloride
Also Known As: methyl 5-bromo-1-(4-hydroxyphenethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate hydrochloride, 5-Bromo-1-[2-(4-hydroxy-phenyl)-ethyl]-6-oxo-1,6-dihydro-pyridine-3-carboxylic acid methyl ester, Opera_ID_1022
Technical Specifications
| Molecular Formula | C15H15BrClNO4 |
| Molecular Weight | 386.9873 g/mol |
| XLogP | 2.7675 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.9873 Da |
| Heavy Atoms | 22 |
| Complexity | 478.0 |
| SMILES | COC(=O)C1=CN(C(=O)C(=C1)Br)CCC2=CC=C(C=C2)O.Cl |
| InChIKey | VWBINDIEQKUENH-UHFFFAOYSA-N |
Chemical Property Profile of Opera_ID_1022
Property Insights of Opera_ID_1022
The XLogP value of 2.7675 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Opera_ID_1022. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Opera_ID_1022. Following Lipinski's Rule of Five, Opera_ID_1022 has 2 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 Opera_ID_1022?
The CAS number of Opera_ID_1022 is 1049751-86-1.
What is the molecular formula of Opera_ID_1022?
The molecular formula of Opera_ID_1022 is C15H15BrClNO4.
What is the molecular weight of Opera_ID_1022?
The molecular weight of Opera_ID_1022 is 386.9873 g/mol.
Where can I buy Opera_ID_1022?
You can request a quote for Opera_ID_1022 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Opera_ID_1022?
Yes, CoreyChem provides custom synthesis services for Opera_ID_1022 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.