![1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone structure](/static/products/4967/496799-44-1.webp)
1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone
TL;DR: 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone (CAS 496799-44-1) is a chemical compound with molecular formula C19H25N3O4 and molecular weight 359.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[8-tert-butyl-2-(4-nitrophenyl)-1-oxa-3,4-diazaspiro[4.5]dec-2-en-4-yl]ethanone
Also Known As: 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone, 1-(8-(tert-butyl)-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl)ethanone, 1-[8-tert-butyl-2-(4-nitrophenyl)-1-oxa-3,4-diazaspiro[4.5]dec-2-en-4-yl]ethanone
| Molecular Formula | C19H25N3O4 |
|---|---|
| Molecular Weight | 359.18 g/mol |
| LogP | 4.0677 |
| Topological Polar Surface Area | 85.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.1845 |
| Heavy Atoms | 26 |
| Complexity | 741.0429 |
Chemical Identifiers
| CAS Number | 496799-44-1 |
|---|---|
| SMILES | CC(=O)N1C2(CCC(CC2)C(C)(C)C)OC(=N1)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone (CAS 496799-44-1), with molecular formula C19H25N3O4 and molecular weight 359.18 g/mol. IUPAC: 1-[8-tert-butyl-2-(4-nitrophenyl)-1-oxa-3,4-diazaspiro[4.5]dec-2-en-4-yl]ethanone.
Chemical Property Profile of 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone
Property Insights of 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone
The XLogP value of 4.0677 indicates that 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone. Following Lipinski's Rule of Five, 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone has 0 hydrogen bond donor(s) and 5 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 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone?
The CAS number of 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone is 496799-44-1.
What is the molecular formula of 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone?
The molecular formula of 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone is C19H25N3O4.
What is the molecular weight of 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone?
The molecular weight of 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone is 359.18 g/mol.
Where can I buy 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone?
You can request a quote for 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[8-tert-butyl-3-(4-nitrophenyl)-4-oxa-1,2-diazaspiro[4.5]dec-2-en-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.