4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide
TL;DR: 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide (CAS 727682-50-0) is a chemical compound with molecular formula C19H22FN3OS and molecular weight 359.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide
Also Known As: 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide, A3788/0160816, 4-[(4-fluorophenyl)amino]-N-(4-methoxyphenyl)piperidine-1-carbothioamide
| Molecular Formula | C19H22FN3OS |
|---|---|
| Molecular Weight | 359.15 g/mol |
| LogP | 4.1076 |
| Topological Polar Surface Area | 36.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.14676 |
| Heavy Atoms | 25 |
| Complexity | 697.6141 |
Chemical Identifiers
| CAS Number | 727682-50-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=S)N2CCC(CC2)NC3=CC=C(C=C3)F |
Product Overview
4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide (CAS 727682-50-0), with molecular formula C19H22FN3OS and molecular weight 359.15 g/mol. IUPAC: 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide.
Chemical Property Profile of 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide
Property Insights of 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide
The XLogP value of 4.1076 indicates that 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.53 Ų, 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide has 2 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 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide?
The CAS number of 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide is 727682-50-0.
What is the molecular formula of 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide?
The molecular formula of 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide is C19H22FN3OS.
What is the molecular weight of 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide?
The molecular weight of 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide is 359.15 g/mol.
Where can I buy 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide?
You can request a quote for 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-fluoroanilino)-N-(4-methoxyphenyl)piperidine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.