N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide
TL;DR: N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide (CAS 25561-81-3) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dihydro-2H-quinoline-1-carbothioyl)benzamide
Also Known As: N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide, N-(1,2,3,4-tetrahydroquinoline-1-carbonothioyl)benzamide, N-(3,4-dihydro-2H-quinoline-1-carbothioyl)benzamide, BAS 00321412, N-[3,4-dihydro-1(2H)-quinolinylcarbothioyl]benzenecarboxamide
| Molecular Formula | C17H16N2OS |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.09833 |
| Heavy Atoms | 21 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 25561-81-3 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=S)NC(=O)C3=CC=CC=C3 |
| InChIKey | IHEOHRXLPNPFTP-UHFFFAOYSA-N |
Product Overview
N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide (CAS 25561-81-3), with molecular formula C17H16N2OS and molecular weight 296.10 g/mol. IUPAC: N-(3,4-dihydro-2H-quinoline-1-carbothioyl)benzamide.
Chemical Property Profile of N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide
Property Insights of N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide
The XLogP value of 3.5 indicates that N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide. Following Lipinski's Rule of Five, N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide 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-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide?
The CAS number of N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide is 25561-81-3.
What is the molecular formula of N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide?
The molecular formula of N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide is C17H16N2OS.
What is the molecular weight of N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide?
The molecular weight of N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide is 296.10 g/mol.
Where can I buy N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide?
You can request a quote for N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,2,3,4-tetrahydroquinoline-1-carbothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.