Mespiperone (11C)
TL;DR: Mespiperone (11C) (CAS 94153-50-1) is a chemical compound with molecular formula C24H28FN3O2 and molecular weight 408.23 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-(111C)methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Also Known As: Mespiperone C 11, Mespiperone (11C), mespiperone c-11, N-Methylspiroperidol, Mespiperona (11c)
| Molecular Formula | C24H28FN3O2 |
|---|---|
| Molecular Weight | 408.23 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 | 408.228 |
| Heavy Atoms | 30 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 94153-50-1 |
|---|---|
| SMILES | [11CH3]N1CN(C2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4 |
| InChIKey | QHJLPOSPWKZACG-BJUDXGSMSA-N |
Product Overview
Mespiperone (11C) (CAS 94153-50-1), with molecular formula C24H28FN3O2 and molecular weight 408.23 g/mol. IUPAC: 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-(111C)methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one.
Chemical Property Profile of Mespiperone (11C)
Property Insights of Mespiperone (11C)
The XLogP value of 3.2 indicates that Mespiperone (11C) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.9 Ų, Mespiperone (11C) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mespiperone (11C) 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 Mespiperone (11C)?
The CAS number of Mespiperone (11C) is 94153-50-1.
What is the molecular formula of Mespiperone (11C)?
The molecular formula of Mespiperone (11C) is C24H28FN3O2.
What is the molecular weight of Mespiperone (11C)?
The molecular weight of Mespiperone (11C) is 408.23 g/mol.
Where can I buy Mespiperone (11C)?
You can request a quote for Mespiperone (11C) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mespiperone (11C)?
Yes, KEHONG BIO provides custom synthesis services for Mespiperone (11C) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.