1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea
TL;DR: 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea (CAS 701281-35-8) is a chemical compound with molecular formula C29H30N4O2S and molecular weight 498.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-(2-phenylethyl)thiourea
Also Known As: 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea, {6-methyl-2-[4-(methylethoxy)phenyl](4-quinolyl)}-N-({[(2-phenylethyl)amino]th ioxomethyl}amino)carboxamide, 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-(2-phenylethyl)thiourea, 2-({6-methyl-2-[4-(propan-2-yloxy)phenyl]quinolin-4-yl}carbonyl)-N-(2-phenylethyl)hydrazinecarbothioamide
| Molecular Formula | C29H30N4O2S |
|---|---|
| Molecular Weight | 498.21 g/mol |
| LogP | 5.34902 |
| Topological Polar Surface Area | 75.28 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.20895 |
| Heavy Atoms | 36 |
| Complexity | 1355.3326 |
Chemical Identifiers
| CAS Number | 701281-35-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(C=C2C(=O)NNC(=S)NCCC3=CC=CC=C3)C4=CC=C(C=C4)OC(C)C |
Product Overview
1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea (CAS 701281-35-8), with molecular formula C29H30N4O2S and molecular weight 498.21 g/mol. IUPAC: 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-(2-phenylethyl)thiourea.
Chemical Property Profile of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea
Property Insights of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea
The XLogP value of 5.34902 indicates that 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea. Following Lipinski's Rule of Five, 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea?
The CAS number of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea is 701281-35-8.
What is the molecular formula of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea?
The molecular formula of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea is C29H30N4O2S.
What is the molecular weight of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea?
The molecular weight of 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea is 498.21 g/mol.
Where can I buy 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea?
You can request a quote for 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[6-methyl-2-(4-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]-3-phenethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.