N-Methylthalidomide
TL;DR: N-Methylthalidomide (CAS 42472-93-5) is a chemical compound with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyl-2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
Also Known As: N-Methylthalidomide, 2-Phthalimido-N-methyl glutarimide, N-Methyl-2-phthalimidoglutarimide, Glutarimide, N-methyl-2-phthalimido-, 2-Phthalimido-N-methyl-glutarimide
| Molecular Formula | C14H12N2O4 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.0797 |
| Heavy Atoms | 20 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 42472-93-5 |
|---|---|
| SMILES | CN1C(=O)CCC(C1=O)N2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | IYYPLFUVXTVBLD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Methylthalidomide (CAS 42472-93-5), with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol. IUPAC: 2-(1-methyl-2,6-dioxopiperidin-3-yl)isoindole-1,3-dione.
Chemical Property Profile of N-Methylthalidomide
Property Insights of N-Methylthalidomide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methylthalidomide. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methylthalidomide. Following Lipinski's Rule of Five, N-Methylthalidomide has 0 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 N-Methylthalidomide?
The CAS number of N-Methylthalidomide is 42472-93-5.
What is the molecular formula of N-Methylthalidomide?
The molecular formula of N-Methylthalidomide is C14H12N2O4.
What is the molecular weight of N-Methylthalidomide?
The molecular weight of N-Methylthalidomide is 272.08 g/mol.
Where can I buy N-Methylthalidomide?
You can request a quote for N-Methylthalidomide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylthalidomide?
Yes, KEHONG BIO provides custom synthesis services for N-Methylthalidomide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.