![4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one structure](/static/products/6158/61588-07-6.webp)
4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one
TL;DR: 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one (CAS 61588-07-6) is a chemical compound with molecular formula C18H27NO2S2 and molecular weight 353.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one
Also Known As: 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one, 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahyd, 4-(Piperidin-1-yl)-4,5,6,7,8,9-hexahydro-2H-spiro[cyclohepta[b]pyran-3,2'-[1,3]dithian]-2-one
| Molecular Formula | C18H27NO2S2 |
|---|---|
| Molecular Weight | 353.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 80.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 353.14832 |
| Heavy Atoms | 23 |
| Complexity | 493.0 |
Chemical Identifiers
| CAS Number | 61588-07-6 |
|---|---|
| SMILES | C1CCC2=C(CC1)OC(=O)C3(C2N4CCCCC4)SCCCS3 |
| InChIKey | LOXJREIATMNLGB-UHFFFAOYSA-N |
Product Overview
4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one (CAS 61588-07-6), with molecular formula C18H27NO2S2 and molecular weight 353.15 g/mol. IUPAC: 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one.
Chemical Property Profile of 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one
Property Insights of 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one
The XLogP value of 3.7 indicates that 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one. Following Lipinski's Rule of Five, 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one 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 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one?
The CAS number of 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one is 61588-07-6.
What is the molecular formula of 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one?
The molecular formula of 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one is C18H27NO2S2.
What is the molecular weight of 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one?
The molecular weight of 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one is 353.15 g/mol.
Where can I buy 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one?
You can request a quote for 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one?
Yes, KEHONG BIO provides custom synthesis services for 4'-piperidin-1-ylspiro[1,3-dithiane-2,3'-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran]-2'-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.