3-Dehydroglutethimide
TL;DR: 3-Dehydroglutethimide (CAS 14149-36-1) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-Dehydroglutethimide
3-ethyl-3-phenylpyridine-2,6-dione
Also Known As: 3-Dehydroglutethimide, 2-Ethyl-2-phenylglutaconimide, 3-ethyl-3-phenylpyridine-2,6-dione, Glutaconimide, 4-ethyl-4-phenyl-, 2,6(1H,3H)-Pyridinedione, 3-ethyl-3-phenyl-
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 14149-36-1 |
|---|---|
| SMILES | CCC1(C=CC(=O)NC1=O)C2=CC=CC=C2 |
| InChIKey | JJRVMNNZSIOQLB-UHFFFAOYSA-N |
Product Overview
3-Dehydroglutethimide (CAS 14149-36-1), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 3-ethyl-3-phenylpyridine-2,6-dione.
Chemical Property Profile of 3-Dehydroglutethimide
Property Insights of 3-Dehydroglutethimide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Dehydroglutethimide. With a topological polar surface area (TPSA) of 46.2 Ų, 3-Dehydroglutethimide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-脱氢谷替米特 has 1 hydrogen bond donor(s) and 2 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 3-脱氢谷替米特?
The CAS number of 3-脱氢谷替米特 is 14149-36-1.
What is the molecular formula of 3-脱氢谷替米特?
The molecular formula of 3-脱氢谷替米特 is C13H13NO2.
What is the molecular weight of 3-脱氢谷替米特?
The molecular weight of 3-脱氢谷替米特 is 215.09 g/mol.
Where can I buy 3-脱氢谷替米特?
You can request a quote for 3-脱氢谷替米特 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-脱氢谷替米特?
Yes, KEHONG BIO provides custom synthesis services for 3-脱氢谷替米特 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.