Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride
TL;DR: Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride (CAS 109696-74-4) is a chemical compound with molecular formula C17H16ClN3O2 and molecular weight 329.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(quinazolin-4-ylamino)benzoate;hydrochloride
Also Known As: Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride, ethyl 4-(quinazolin-4-ylamino)benzoate, chloride, ethyl 4-(4-quinazolinylamino)benzoate hydrochloride
| Molecular Formula | C17H16ClN3O2 |
|---|---|
| Molecular Weight | 329.09 g/mol |
| LogP | 3.9719 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.0931 |
| Heavy Atoms | 23 |
| Complexity | 801.0525 |
Chemical Identifiers
| CAS Number | 109696-74-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=CC=CC=C32.Cl |
Product Overview
Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride (CAS 109696-74-4), with molecular formula C17H16ClN3O2 and molecular weight 329.09 g/mol. IUPAC: ethyl 4-(quinazolin-4-ylamino)benzoate;hydrochloride.
Chemical Property Profile of Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride
Property Insights of Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride
The XLogP value of 3.9719 indicates that Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride. Following Lipinski's Rule of Five, Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride has 1 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 4-(quinazolin-4-ylamino)benzoate Hydrochloride?
The CAS number of Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride is 109696-74-4.
What is the molecular formula of Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride?
The molecular formula of Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride is C17H16ClN3O2.
What is the molecular weight of Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride?
The molecular weight of Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride is 329.09 g/mol.
Where can I buy Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride?
You can request a quote for Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(quinazolin-4-ylamino)benzoate Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.