![N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide structure](/static/products/4452/445237-52-5.webp)
N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide
TL;DR: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide (CAS 445237-52-5) is a chemical compound with molecular formula C30H31N3O4S and molecular weight 529.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide
Also Known As: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-{[2-(3-isopropoxyphenyl)-4-quinolinyl]carbonyl}thiourea, N-(3,4-DIMETHOXYPHENETHYL)-N'-{[2-(3-ISOPROPOXYPHENYL)-4-QUINOLYL]CARBONYL}THIOUREA, N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamothioyl}-2-[3-(propan-2-yloxy)phenyl]quinoline-4-carboxamide
| Molecular Formula | C30H31N3O4S |
|---|---|
| Molecular Weight | 529.20 g/mol |
| LogP | 5.5532 |
| Topological Polar Surface Area | 81.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 529.20355 |
| Heavy Atoms | 38 |
| Complexity | 1454.8949 |
Chemical Identifiers
| CAS Number | 445237-52-5 |
|---|---|
| SMILES | CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NCCC4=CC(=C(C=C4)OC)OC |
Product Overview
N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide (CAS 445237-52-5), with molecular formula C30H31N3O4S and molecular weight 529.20 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide.
Chemical Property Profile of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide
Property Insights of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide
The XLogP value of 5.5532 indicates that N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.71 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide. Following Lipinski's Rule of Five, N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide?
The CAS number of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide is 445237-52-5.
What is the molecular formula of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide?
The molecular formula of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide is C30H31N3O4S.
What is the molecular weight of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide?
The molecular weight of N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide is 529.20 g/mol.
Where can I buy N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide?
You can request a quote for N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.