(4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate
TL;DR: (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate (CAS 923858-19-9) is a chemical compound with molecular formula C16H14N4O2S and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-aminoquinazolin-2-yl)methyl 2-methylsulfanylpyridine-3-carboxylate
Also Known As: starbld0008856, (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate, (4-aminoquinazolin-2-yl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate, (4-aminoquinazolin-2-yl)methyl 2-methylsulfanylpyridine-3-carboxylate
| Molecular Formula | C16H14N4O2S |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 2.6859 |
| Topological Polar Surface Area | 90.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.08374 |
| Heavy Atoms | 23 |
| Complexity | 869.57806 |
Chemical Identifiers
| CAS Number | 923858-19-9 |
|---|---|
| SMILES | CSC1=C(C=CC=N1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N |
Product Overview
(4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate (CAS 923858-19-9), with molecular formula C16H14N4O2S and molecular weight 326.08 g/mol. IUPAC: (4-aminoquinazolin-2-yl)methyl 2-methylsulfanylpyridine-3-carboxylate.
Chemical Property Profile of (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate
Property Insights of (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate
The XLogP value of 2.6859 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate. The TPSA of 90.99 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate. Following Lipinski's Rule of Five, (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate has 1 hydrogen bond donor(s) and 7 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 (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate?
The CAS number of (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate is 923858-19-9.
What is the molecular formula of (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate?
The molecular formula of (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate is C16H14N4O2S.
What is the molecular weight of (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate?
The molecular weight of (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate is 326.08 g/mol.
Where can I buy (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate?
You can request a quote for (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate?
Yes, KEHONG BIO provides custom synthesis services for (4-Aminoquinazolin-2-yl)methyl 2-(methylthio)nicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.