2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide
TL;DR: 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide (CAS 40889-55-2) is a chemical compound with molecular formula C19H19N5O2S and molecular weight 381.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(3-methylphenyl)thiourea
Also Known As: 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide, 3(4H)-Quinazolineacetic acid, 2-methyl-4-oxo-, 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide, 1-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(3-methylphenyl)thiourea, 2-[1-Hydroxy-2-(2-methyl-4-oxoquinazolin-3(4H)-yl)ethylidene]-N-(3-methylphenyl)hydrazine-1-carboximidothioic acid, BRN 0856857
| Molecular Formula | C19H19N5O2S |
|---|---|
| Molecular Weight | 381.13 g/mol |
| LogP | 2.03114 |
| Topological Polar Surface Area | 88.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.12595 |
| Heavy Atoms | 27 |
| Complexity | 1077.1282 |
Chemical Identifiers
| CAS Number | 40889-55-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=S)NNC(=O)CN2C(=NC3=CC=CC=C3C2=O)C |
Product Overview
2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide (CAS 40889-55-2), with molecular formula C19H19N5O2S and molecular weight 381.13 g/mol. IUPAC: 1-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(3-methylphenyl)thiourea.
Chemical Property Profile of 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide
Property Insights of 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide
The XLogP value of 2.03114 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide. The TPSA of 88.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide. Following Lipinski's Rule of Five, 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide has 3 hydrogen bond donor(s) and 4 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 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide?
The CAS number of 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide is 40889-55-2.
What is the molecular formula of 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide?
The molecular formula of 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide is C19H19N5O2S.
What is the molecular weight of 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide?
The molecular weight of 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide is 381.13 g/mol.
Where can I buy 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide?
You can request a quote for 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-oxo-3(4H)-quinazolineacetic acid 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.