![6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one structure](/static/products/781/781656-65-3.png)
6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one
TL;DR: 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one (CAS 781656-65-3) is a chemical compound with molecular formula C16H15NO3S2 and molecular weight 333.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-piperidin-1-ylsulfonyl-2-thiatricyclo[6.3.1.04,12]dodeca-1(12),4,6,8,10-pentaen-3-one
Also Known As: 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one, AQ-390/42425793, 9-piperidin-1-ylsulfonyl-2-thiatricyclo[6.3.1.04,12]dodeca-1(12),4,6,8,10-pentaen-3-one
| Molecular Formula | C16H15NO3S2 |
|---|---|
| Molecular Weight | 333.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.04935 |
| Heavy Atoms | 22 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 781656-65-3 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=C3C=CC=C4C3=C(C=C2)SC4=O |
| InChIKey | LQLUJRRQPSPYDB-UHFFFAOYSA-N |
Product Overview
6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one (CAS 781656-65-3), with molecular formula C16H15NO3S2 and molecular weight 333.05 g/mol. IUPAC: 9-piperidin-1-ylsulfonyl-2-thiatricyclo[6.3.1.04,12]dodeca-1(12),4,6,8,10-pentaen-3-one.
Chemical Property Profile of 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one
Property Insights of 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one
The XLogP value of 3.2 indicates that 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one. Following Lipinski's Rule of Five, 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-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 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one?
The CAS number of 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one is 781656-65-3.
What is the molecular formula of 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one?
The molecular formula of 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one is C16H15NO3S2.
What is the molecular weight of 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one?
The molecular weight of 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one is 333.05 g/mol.
Where can I buy 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one?
You can request a quote for 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(1-piperidinylsulfonyl)-2H-naphtho[1,8-bc]thiophen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.