![2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one structure](/static/products/7918/791804-89-2.webp)
2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one
TL;DR: 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one (CAS 791804-89-2) is a chemical compound with molecular formula C18H20N2O3S and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-1-piperidin-1-ylpropan-1-one
Also Known As: 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one, 2-(1-methyl-2-oxo-2-piperidinoethyl)-1lambda~6~-naphtho[1,8-cd]isothiazole-1,1(2H)-dione, 2-[1-methyl-2-oxo-2-(1-piperidinyl)ethyl]-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide, 2-(2,2-dioxo-2lambda6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-1-piperidin-1-ylpropan-1-one
| Molecular Formula | C18H20N2O3S |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 2.7495 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.11948 |
| Heavy Atoms | 24 |
| Complexity | 911.75586 |
Chemical Identifiers
| CAS Number | 791804-89-2 |
|---|---|
| SMILES | CC(C(=O)N1CCCCC1)N2C3=CC=CC4=C3C(=CC=C4)S2(=O)=O |
Product Overview
2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one (CAS 791804-89-2), with molecular formula C18H20N2O3S and molecular weight 344.12 g/mol. IUPAC: 2-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-1-piperidin-1-ylpropan-1-one.
Chemical Property Profile of 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one
Property Insights of 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one
The XLogP value of 2.7495 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one. With a topological polar surface area (TPSA) of 57.69 Ų, 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-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 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one?
The CAS number of 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one is 791804-89-2.
What is the molecular formula of 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one?
The molecular formula of 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one is C18H20N2O3S.
What is the molecular weight of 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one?
The molecular weight of 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one is 344.12 g/mol.
Where can I buy 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one?
You can request a quote for 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,1-dioxido-2H-naphtho[1,8-cd]isothiazol-2-yl)-1-(piperidin-1-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.