MPTP
TL;DR: MPTP (CAS 28289-54-5) is a chemical compound with molecular formula C12H15N and molecular weight 173.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
MPTP
1-methyl-4-phenyl-3,6-dihydro-2H-pyridine
Also Known As: MPTP, 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine, Pethidine EP Impurity B, Perindopril EP Impurity N, MPTP [MI]
| Molecular Formula | C12H15N |
|---|---|
| Molecular Weight | 173.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.12045 |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
| Melting Point | 40-42 °C |
| Boiling Point | 85 to 90 °C @ 0.8 mm Hg |
| Vapor Pressure | 0.00945 [mmHg] |
Chemical Identifiers
| CAS Number | 28289-54-5 |
|---|---|
| SMILES | CN1CCC(=CC1)C2=CC=CC=C2 |
| InChIKey | PLRACCBDVIHHLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
MPTP (CAS 28289-54-5), with molecular formula C12H15N and molecular weight 173.12 g/mol. IUPAC: 1-methyl-4-phenyl-3,6-dihydro-2H-pyridine.
Chemical Property Profile of MPTP
Property Insights of MPTP
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for MPTP. With a topological polar surface area (TPSA) of 3.2 Ų, MPTP exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, MPTP has 0 hydrogen bond donor(s) and 1 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 MPTP?
The CAS number of MPTP is 28289-54-5.
What is the molecular formula of MPTP?
The molecular formula of MPTP is C12H15N.
What is the molecular weight of MPTP?
The molecular weight of MPTP is 173.12 g/mol.
Where can I buy MPTP?
You can request a quote for MPTP directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MPTP?
Yes, KEHONG BIO provides custom synthesis services for MPTP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.