![8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane structure](/static/products/7123/712347-31-4.webp)
8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane
TL;DR: 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane (CAS 712347-31-4) is a chemical compound with molecular formula C17H18Cl2N2O4 and molecular weight 384.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
Also Known As: 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane, AN-329/43211362, [3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone, [3-(3,4-dichlorophenyl)-2-isoxazolin-5-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone, [3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl](1,4-dioxa-8-azaspiro[4.5]dec-8-yl)methanone
| Molecular Formula | C17H18Cl2N2O4 |
|---|---|
| Molecular Weight | 384.06 g/mol |
| LogP | 2.8519 |
| Topological Polar Surface Area | 60.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 384.06436 |
| Heavy Atoms | 25 |
| Complexity | 708.5994 |
Chemical Identifiers
| CAS Number | 712347-31-4 |
|---|---|
| SMILES | C1CN(CCC12OCCO2)C(=O)C3CC(=NO3)C4=CC(=C(C=C4)Cl)Cl |
Product Overview
8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane (CAS 712347-31-4), with molecular formula C17H18Cl2N2O4 and molecular weight 384.06 g/mol. IUPAC: [3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone.
Chemical Property Profile of 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane
Property Insights of 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane
The XLogP value of 2.8519 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane. The TPSA of 60.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane. Following Lipinski's Rule of Five, 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane 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 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane?
The CAS number of 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane is 712347-31-4.
What is the molecular formula of 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane?
The molecular formula of 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane is C17H18Cl2N2O4.
What is the molecular weight of 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane?
The molecular weight of 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane is 384.06 g/mol.
Where can I buy 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane?
You can request a quote for 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane?
Yes, KEHONG BIO provides custom synthesis services for 8-{[3-(3,4-dichlorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.