2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester
TL;DR: 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester (CAS 839-26-9) is a chemical compound with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetate
Also Known As: NIOSH/HM2476800, ethyl 2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetate, (2,4-dioxo-1,3-diaza-spiro[4.5]dec-3-yl)-acetic acid ethyl ester, 1,3-Diazaspiro(4.5)decane-3-acetic acid, 2,4-dioxo-, ethyl ester, 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester
| Molecular Formula | C12H18N2O4 |
|---|---|
| Molecular Weight | 254.13 g/mol |
| LogP | 0.8042 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.12666 |
| Heavy Atoms | 18 |
| Complexity | 374.2737 |
Chemical Identifiers
| CAS Number | 839-26-9 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)C2(CCCCC2)NC1=O |
Product Overview
2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester (CAS 839-26-9), with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol. IUPAC: ethyl 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetate.
Chemical Property Profile of 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester
Property Insights of 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester
The XLogP value of 0.8042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester. Following Lipinski's Rule of Five, 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester has 1 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 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester?
The CAS number of 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester is 839-26-9.
What is the molecular formula of 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester?
The molecular formula of 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester is C12H18N2O4.
What is the molecular weight of 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester?
The molecular weight of 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester is 254.13 g/mol.
Where can I buy 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester?
You can request a quote for 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dioxo-1,3-diazaspiro(4.5)decane-3-acetic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.