N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide
TL;DR: N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide (CAS 315248-85-2) is a chemical compound with molecular formula C16H15FN2S and molecular weight 286.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-3,4-dihydro-2H-quinoline-1-carbothioamide
Also Known As: ChemDiv1_023290, BIM-0047682.P001, N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide, N-(4-fluorophenyl)-3,4-dihydro-2H-quinoline-1-carbothioamide, N-(4-fluorophenyl)-3,4-dihydroquinoline-1(2H)-carbothioamide
| Molecular Formula | C16H15FN2S |
|---|---|
| Molecular Weight | 286.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 47.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 286.094 |
| Heavy Atoms | 20 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 315248-85-2 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=S)NC3=CC=C(C=C3)F |
| InChIKey | DEJVDFMUCXKBMD-UHFFFAOYSA-N |
Product Overview
N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide (CAS 315248-85-2), with molecular formula C16H15FN2S and molecular weight 286.09 g/mol. IUPAC: N-(4-fluorophenyl)-3,4-dihydro-2H-quinoline-1-carbothioamide.
Chemical Property Profile of N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide
Property Insights of N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide
The XLogP value of 3.8 indicates that N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.4 Ų, N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide has 1 hydrogen bond donor(s) and 2 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 N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide?
The CAS number of N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide is 315248-85-2.
What is the molecular formula of N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide?
The molecular formula of N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide is C16H15FN2S.
What is the molecular weight of N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide?
The molecular weight of N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide is 286.09 g/mol.
Where can I buy N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide?
You can request a quote for N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorophenyl)-3,4-dihydro-1(2H)-quinolinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.