Dabelotine
TL;DR: Dabelotine (CAS 118976-38-8) is a chemical compound with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-methyl-3,4-dihydro-2H-quinolin-8-yl)oxymethyl]morpholine
Also Known As: Dabelotine, dabelotina, Dabelotine [INN], dabelotinum, Z-Ser-OH
| Molecular Formula | C15H22N2O2 |
|---|---|
| Molecular Weight | 262.17 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 33.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.16812 |
| Heavy Atoms | 19 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 118976-38-8 |
|---|---|
| SMILES | CN1CCCC2=C1C(=CC=C2)OCC3CNCCO3 |
| InChIKey | VXQWMLATWQSCBE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dabelotine (CAS 118976-38-8), with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol. IUPAC: 2-[(1-methyl-3,4-dihydro-2H-quinolin-8-yl)oxymethyl]morpholine.
Chemical Property Profile of Dabelotine
Property Insights of Dabelotine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dabelotine. With a topological polar surface area (TPSA) of 33.7 Ų, Dabelotine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dabelotine has 1 hydrogen bond donor(s) and 4 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 Dabelotine?
The CAS number of Dabelotine is 118976-38-8.
What is the molecular formula of Dabelotine?
The molecular formula of Dabelotine is C15H22N2O2.
What is the molecular weight of Dabelotine?
The molecular weight of Dabelotine is 262.17 g/mol.
Where can I buy Dabelotine?
You can request a quote for Dabelotine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dabelotine?
Yes, KEHONG BIO provides custom synthesis services for Dabelotine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.