![1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene structure](/static/products/6639/663945-41-3.webp)
1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene
TL;DR: 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene (CAS 663945-41-3) is a chemical compound with molecular formula C15H17ClN2O2 and molecular weight 292.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3-chloro-4-methylphenyl)-1-oxa-3,4-diazaspiro[4.4]non-2-en-4-yl]ethanone
Also Known As: 1-acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene, 1-[2-(3-chloro-4-methylphenyl)-1-oxa-3,4-diazaspiro[4.4]non-2-en-4-yl]ethanone, 1-(3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl)ethanone, 1-[3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]ethanone, 1-[8-(3-chloro-4-methylphenyl)-9-oxa-6,7-diazaspiro[4.4]non-7-en-6-yl]ethanone
| Molecular Formula | C15H17ClN2O2 |
|---|---|
| Molecular Weight | 292.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 292.09787 |
| Heavy Atoms | 20 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 663945-41-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN(C3(O2)CCCC3)C(=O)C)Cl |
| InChIKey | YBHODASJLPYWDO-UHFFFAOYSA-N |
Product Overview
1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene (CAS 663945-41-3), with molecular formula C15H17ClN2O2 and molecular weight 292.10 g/mol. IUPAC: 1-[2-(3-chloro-4-methylphenyl)-1-oxa-3,4-diazaspiro[4.4]non-2-en-4-yl]ethanone.
Chemical Property Profile of 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene
Property Insights of 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene
The XLogP value of 3.5 indicates that 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene has 0 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 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene?
The CAS number of 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene is 663945-41-3.
What is the molecular formula of 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene?
The molecular formula of 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene is C15H17ClN2O2.
What is the molecular weight of 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene?
The molecular weight of 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene is 292.10 g/mol.
Where can I buy 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene?
You can request a quote for 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.