![4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone structure](/static/products/7778/777872-65-8.webp)
4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
TL;DR: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone (CAS 777872-65-8) is a chemical compound with molecular formula C20H25N3OS and molecular weight 355.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
Also Known As: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone, (4-pyridin-2-ylpiperazin-1-yl)-(9-thiabicyclo[6.3.0]undeca-10,12-dien-10-yl)methanone, 4,5,6,7,8,9-hexahydrocycloocta[1,2-d]thiophen-2-yl 4-(2-pyridyl)piperazinyl ke tone, 4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIOPHEN-2-YL[4-(2-PYRIDYL)PIPERAZINO]METHANONE, 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl[4-(pyridin-2-yl)piperazin-1-yl]methanone
| Molecular Formula | C20H25N3OS |
|---|---|
| Molecular Weight | 355.17 g/mol |
| LogP | 3.7645 |
| Topological Polar Surface Area | 36.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.17184 |
| Heavy Atoms | 25 |
| Complexity | 694.2974 |
Chemical Identifiers
| CAS Number | 777872-65-8 |
|---|---|
| SMILES | C1CCCC2=C(CC1)C=C(S2)C(=O)N3CCN(CC3)C4=CC=CC=N4 |
Product Overview
4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone (CAS 777872-65-8), with molecular formula C20H25N3OS and molecular weight 355.17 g/mol. IUPAC: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone.
Chemical Property Profile of 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
Property Insights of 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
The XLogP value of 3.7645 indicates that 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.44 Ų, 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone has 0 hydrogen bond donor(s) and 4 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 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
The CAS number of 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone is 777872-65-8.
What is the molecular formula of 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
The molecular formula of 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone is C20H25N3OS.
What is the molecular weight of 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
The molecular weight of 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone is 355.17 g/mol.
Where can I buy 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
You can request a quote for 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.