![N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide structure](/static/products/4780/478067-85-5.webp)
N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide
TL;DR: N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide (CAS 478067-85-5) is a chemical compound with molecular formula C18H23F3N2OS and molecular weight 372.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclooctyl-2-(3,4,4-trifluorobut-3-enylsulfanyl)pyridine-3-carboxamide
Also Known As: Bionet1_003583, 7N-781, N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide, N-cyclooctyl-2-(3,4,4-trifluorobut-3-enylsulfanyl)pyridine-3-carboxamide, N-cyclooctyl-2-[(3,4,4-trifluorobut-3-en-1-yl)sulfanyl]pyridine-3-carboxamide
| Molecular Formula | C18H23F3N2OS |
|---|---|
| Molecular Weight | 372.15 g/mol |
| LogP | 5.4841 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.14832 |
| Heavy Atoms | 25 |
| Complexity | 597.7389 |
Chemical Identifiers
| CAS Number | 478067-85-5 |
|---|---|
| SMILES | C1CCCC(CCC1)NC(=O)C2=C(N=CC=C2)SCCC(=C(F)F)F |
Product Overview
N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide (CAS 478067-85-5), with molecular formula C18H23F3N2OS and molecular weight 372.15 g/mol. IUPAC: N-cyclooctyl-2-(3,4,4-trifluorobut-3-enylsulfanyl)pyridine-3-carboxamide.
Chemical Property Profile of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide
Property Insights of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide
The XLogP value of 5.4841 indicates that N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide?
The CAS number of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide is 478067-85-5.
What is the molecular formula of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide?
The molecular formula of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide is C18H23F3N2OS.
What is the molecular weight of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide?
The molecular weight of N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide is 372.15 g/mol.
Where can I buy N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide?
You can request a quote for N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclooctyl-2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.