11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione
TL;DR: 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione (CAS 67196-38-7) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-propan-2-yl-2,4-diazaspiro[5.5]undec-8-ene-1,3,5-trione
Also Known As: 2,3,5-trione, 11-isopropyl-, 11-Isopropyl-2,4-diazaspiro[5.5]undec-8-ene-1,3,5-trione, 2,3,5-trione, 11-(1-methylethyl)-, 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione, 4-24-00-02054 (Beilstein Handbook Reference)
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 67196-38-7 |
|---|---|
| SMILES | CC(C)C1CC=CCC12C(=O)NC(=O)NC2=O |
| InChIKey | NRKLETLAVYJHBG-UHFFFAOYSA-N |
Product Overview
11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione (CAS 67196-38-7), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: 11-propan-2-yl-2,4-diazaspiro[5.5]undec-8-ene-1,3,5-trione.
Chemical Property Profile of 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione
Property Insights of 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione. Following Lipinski's Rule of Five, 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione has 2 hydrogen bond donor(s) and 3 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 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione?
The CAS number of 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione is 67196-38-7.
What is the molecular formula of 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione?
The molecular formula of 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione is C12H16N2O3.
What is the molecular weight of 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione?
The molecular weight of 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione is 236.12 g/mol.
Where can I buy 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione?
You can request a quote for 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione?
Yes, KEHONG BIO provides custom synthesis services for 11-Isopropyl-2,4-diazaspiro(5.5)undec-8-ene-1,3,5-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.