Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate
TL;DR: Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate (CAS 371203-65-5) is a chemical compound with molecular formula C13H9ClF6N2O2 and molecular weight 374.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-chloro-2,4-bis(trifluoromethyl)-1H-quinazoline-4-carboxylate
Also Known As: ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate, ethyl 6-chloro-2,4-bis(trifluoromethyl)-1H-quinazoline-4-carboxylate, ethyl 2,4-bis(trifluoromethyl)-6-chloro-3,4-dihydroquinazoline-4-carboxylate
| Molecular Formula | C13H9ClF6N2O2 |
|---|---|
| Molecular Weight | 374.03 g/mol |
| LogP | 4.047 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.02567 |
| Heavy Atoms | 24 |
| Complexity | 700.6828 |
Chemical Identifiers
| CAS Number | 371203-65-5 |
|---|---|
| SMILES | CCOC(=O)C1(C2=C(C=CC(=C2)Cl)NC(=N1)C(F)(F)F)C(F)(F)F |
Product Overview
Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate (CAS 371203-65-5), with molecular formula C13H9ClF6N2O2 and molecular weight 374.03 g/mol. IUPAC: ethyl 6-chloro-2,4-bis(trifluoromethyl)-1H-quinazoline-4-carboxylate.
Chemical Property Profile of Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate
Property Insights of Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate
The XLogP value of 4.047 indicates that Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.69 Ų, Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate has 1 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 Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate?
The CAS number of Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate is 371203-65-5.
What is the molecular formula of Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate?
The molecular formula of Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate is C13H9ClF6N2O2.
What is the molecular weight of Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate?
The molecular weight of Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate is 374.03 g/mol.
Where can I buy Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate?
You can request a quote for Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-chloro-2,4-bis(trifluoromethyl)-3,4-dihydroquinazoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.