![1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one structure](/static/products/5959/5959-28-4.webp)
1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one
TL;DR: 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one (CAS 5959-28-4) is a chemical compound with molecular formula C19H24Cl2N2O2S and molecular weight 414.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[8-(3,4-dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one
Also Known As: 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one, 1-[8-(3,4-dichlorobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methylbutan-1-one
| Molecular Formula | C19H24Cl2N2O2S |
|---|---|
| Molecular Weight | 414.09 g/mol |
| LogP | 4.5472 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.09357 |
| Heavy Atoms | 26 |
| Complexity | 702.7796 |
Chemical Identifiers
| CAS Number | 5959-28-4 |
|---|---|
| SMILES | CC(C)CC(=O)N1CCSC12CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one (CAS 5959-28-4), with molecular formula C19H24Cl2N2O2S and molecular weight 414.09 g/mol. IUPAC: 1-[8-(3,4-dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one.
Chemical Property Profile of 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one
Property Insights of 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one
The XLogP value of 4.5472 indicates that 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one 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-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one?
The CAS number of 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one is 5959-28-4.
What is the molecular formula of 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one?
The molecular formula of 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one is C19H24Cl2N2O2S.
What is the molecular weight of 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one?
The molecular weight of 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one is 414.09 g/mol.
Where can I buy 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one?
You can request a quote for 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[8-(3,4-Dichlorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-4-yl]-3-methylbutan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.