N-Methylspiroperidol
TL;DR: N-Methylspiroperidol (CAS 87539-19-3) is a chemical compound with molecular formula C24H28FN3O2 and molecular weight 409.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[4-(4-fluorophenyl)-4-oxobutyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Also Known As: 3-N-Methylspiperone, N-Methylspiperone, N-Methylspiroperidol, Mespiperone, Methylspiperone
| Molecular Formula | C24H28FN3O2 |
|---|---|
| Molecular Weight | 409.22 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 43.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.21655 |
| Heavy Atoms | 30 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 87539-19-3 |
|---|---|
| SMILES | CN1CN(C2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4 |
| InChIKey | QHJLPOSPWKZACG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Methylspiroperidol (CAS 87539-19-3), with molecular formula C24H28FN3O2 and molecular weight 409.22 g/mol. IUPAC: 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one.
Chemical Property Profile of N-Methylspiroperidol
Property Insights of N-Methylspiroperidol
The XLogP value of 3.2 indicates that N-Methylspiroperidol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.9 Ų, N-Methylspiroperidol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methylspiroperidol has 0 hydrogen bond donor(s) and 5 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 N-Methylspiroperidol?
The CAS number of N-Methylspiroperidol is 87539-19-3.
What is the molecular formula of N-Methylspiroperidol?
The molecular formula of N-Methylspiroperidol is C24H28FN3O2.
What is the molecular weight of N-Methylspiroperidol?
The molecular weight of N-Methylspiroperidol is 409.22 g/mol.
Where can I buy N-Methylspiroperidol?
You can request a quote for N-Methylspiroperidol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylspiroperidol?
Yes, KEHONG BIO provides custom synthesis services for N-Methylspiroperidol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.