Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate
TL;DR: Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate (CAS 276254-30-9) is a chemical compound with molecular formula C12H9ClN4O2 and molecular weight 276.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate
Also Known As: ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate, 3-ethoxycarbonyl-5-chloro-1,2,3-triazolo[1,5-a]quinazoline, ethyl 5-chloro[1,2,3]triazolo[1,5-a]quinazoline-3-carboxylate
| Molecular Formula | C12H9ClN4O2 |
|---|---|
| Molecular Weight | 276.04 g/mol |
| LogP | 2.1076 |
| Topological Polar Surface Area | 69.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.0414 |
| Heavy Atoms | 19 |
| Complexity | 783.841 |
Chemical Identifiers
| CAS Number | 276254-30-9 |
|---|---|
| SMILES | CCOC(=O)C1=C2N=C(C3=CC=CC=C3N2N=N1)Cl |
Product Overview
Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate (CAS 276254-30-9), with molecular formula C12H9ClN4O2 and molecular weight 276.04 g/mol. IUPAC: ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate.
Chemical Property Profile of Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate
Property Insights of Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate
The XLogP value of 2.1076 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate. The TPSA of 69.38 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate has 0 hydrogen bond donor(s) and 5 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 Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate?
The CAS number of Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate is 276254-30-9.
What is the molecular formula of Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate?
The molecular formula of Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate is C12H9ClN4O2.
What is the molecular weight of Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate?
The molecular weight of Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate is 276.04 g/mol.
Where can I buy Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate?
You can request a quote for Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-chlorotriazolo[1,5-a]quinazoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.