Opera_ID_761
TL;DR: Opera_ID_761 (CAS 1052532-99-6) is a chemical compound with molecular formula C15H20ClNO4 and molecular weight 313.1081 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-methylpiperidin-3-yl) 2,3-dihydro-1,4-benzodioxine-6-carboxylate;hydrochloride
Also Known As: 1-methylpiperidin-3-yl 2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylate hydrochloride, (1-methylpiperidin-3-yl) 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride, 2,3-Dihydro-benzo[1,4]dioxine-6-carboxylic acid 1-methyl-piperidin-3-yl ester, Opera_ID_761
Technical Specifications
| Molecular Formula | C15H20ClNO4 |
| Molecular Weight | 313.1081 g/mol |
| XLogP | 2.1306 |
| Topological Polar Surface Area (TPSA) | 48.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.1081 Da |
| Heavy Atoms | 21 |
| Complexity | 349.0 |
| SMILES | CN1CCCC(C1)OC(=O)C2=CC3=C(C=C2)OCCO3.Cl |
| InChIKey | HLWBIJAUZVLMGX-UHFFFAOYSA-N |
Chemical Property Profile of Opera_ID_761
Property Insights of Opera_ID_761
The XLogP value of 2.1306 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Opera_ID_761. With a topological polar surface area (TPSA) of 48.0 Ų, Opera_ID_761 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Opera_ID_761 has 1 hydrogen bond donor(s) and 6 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_761?
The CAS number of Opera_ID_761 is 1052532-99-6.
What is the molecular formula of Opera_ID_761?
The molecular formula of Opera_ID_761 is C15H20ClNO4.
What is the molecular weight of Opera_ID_761?
The molecular weight of Opera_ID_761 is 313.1081 g/mol.
Where can I buy Opera_ID_761?
You can request a quote for Opera_ID_761 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Opera_ID_761?
Yes, CoreyChem provides custom synthesis services for Opera_ID_761 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.