(2-(Trifluoromethyl)quinazolin-4-yl)-L-proline
TL;DR: (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline (CAS 1008592-58-2) is a chemical compound with molecular formula C14H12F3N3O2 and molecular weight 311.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic acid
Also Known As: (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline, 1-[2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic Acid, (2S)-1-[2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic acid
| Molecular Formula | C14H12F3N3O2 |
|---|---|
| Molecular Weight | 311.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 66.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 311.08817 |
| Heavy Atoms | 22 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 1008592-58-2 |
|---|---|
| SMILES | C1C[C@H](N(C1)C2=NC(=NC3=CC=CC=C32)C(F)(F)F)C(=O)O |
| InChIKey | KSUJYIKOZJYCCV-JTQLQIEISA-N |
Product Overview
(2-(Trifluoromethyl)quinazolin-4-yl)-L-proline (CAS 1008592-58-2), with molecular formula C14H12F3N3O2 and molecular weight 311.09 g/mol. IUPAC: (2S)-1-[2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline
Property Insights of (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline
The XLogP value of 3.0 indicates that (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline. Following Lipinski's Rule of Five, (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline has 1 hydrogen bond donor(s) and 8 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-(Trifluoromethyl)quinazolin-4-yl)-L-proline?
The CAS number of (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline is 1008592-58-2.
What is the molecular formula of (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline?
The molecular formula of (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline is C14H12F3N3O2.
What is the molecular weight of (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline?
The molecular weight of (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline is 311.09 g/mol.
Where can I buy (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline?
You can request a quote for (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline?
Yes, KEHONG BIO provides custom synthesis services for (2-(Trifluoromethyl)quinazolin-4-yl)-L-proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.