1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea
TL;DR: 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea (CAS 438235-63-3) is a chemical compound with molecular formula C23H26N4OS and molecular weight 406.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(4-butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea
Also Known As: 1-[[2-(4-butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea, 2-({2-[4-(butan-2-yl)phenyl]quinolin-4-yl}carbonyl)-N-ethylhydrazinecarbothioamide, 2-{[2-(4-sec-butylphenyl)-4-quinolinyl]carbonyl}-N-ethylhydrazinecarbothioamide, N-{[(ethylamino)thioxomethyl]amino}{2-[4-(methylpropyl)phenyl](4-quinolyl)}car boxamide
| Molecular Formula | C23H26N4OS |
|---|---|
| Molecular Weight | 406.18 g/mol |
| LogP | 4.5441 |
| Topological Polar Surface Area | 66.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.18274 |
| Heavy Atoms | 29 |
| Complexity | 1017.0665 |
Chemical Identifiers
| CAS Number | 438235-63-3 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NCC |
Product Overview
1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea (CAS 438235-63-3), with molecular formula C23H26N4OS and molecular weight 406.18 g/mol. IUPAC: 1-[[2-(4-butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea.
Chemical Property Profile of 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea
Property Insights of 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea
The XLogP value of 4.5441 indicates that 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea. Following Lipinski's Rule of Five, 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea has 3 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 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea?
The CAS number of 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea is 438235-63-3.
What is the molecular formula of 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea?
The molecular formula of 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea is C23H26N4OS.
What is the molecular weight of 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea?
The molecular weight of 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea is 406.18 g/mol.
Where can I buy 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea?
You can request a quote for 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(4-Butan-2-ylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.