ChemDiv1_023408
TL;DR: ChemDiv1_023408 (CAS 425656-09-3) is a chemical compound with molecular formula C21H17FN2O3S and molecular weight 396.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(4-fluorophenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: ChemDiv1_023408, AM-879/14775202, ethyl 5-(4-fluorophenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 5-(4-fluorophenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL 5-(4-FLUOROPHENYL)-3-OXO-7-PHENYL-2H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C21H17FN2O3S |
|---|---|
| Molecular Weight | 396.09 g/mol |
| LogP | 3.7862 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.0944 |
| Heavy Atoms | 28 |
| Complexity | 986.4701 |
Chemical Identifiers
| CAS Number | 425656-09-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)F)C(=O)CS2)C4=CC=CC=C4 |
Product Overview
ChemDiv1_023408 (CAS 425656-09-3), with molecular formula C21H17FN2O3S and molecular weight 396.09 g/mol. IUPAC: ethyl 5-(4-fluorophenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of ChemDiv1_023408
Property Insights of ChemDiv1_023408
The XLogP value of 3.7862 indicates that ChemDiv1_023408 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, ChemDiv1_023408 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_023408 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 ChemDiv1_023408?
The CAS number of ChemDiv1_023408 is 425656-09-3.
What is the molecular formula of ChemDiv1_023408?
The molecular formula of ChemDiv1_023408 is C21H17FN2O3S.
What is the molecular weight of ChemDiv1_023408?
The molecular weight of ChemDiv1_023408 is 396.09 g/mol.
Where can I buy ChemDiv1_023408?
You can request a quote for ChemDiv1_023408 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023408?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023408 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.