ChemDiv1_004252
TL;DR: ChemDiv1_004252 (CAS 292641-79-3) is a chemical compound with molecular formula C25H24N2O5S2 and molecular weight 496.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: ChemDiv1_004252, (Z)-ethyl 2-(3-hydroxy-4-methoxybenzylidene)-7-methyl-5-(4-(methylthio)phenyl)-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-(3-hydroxy-4-methoxybenzylidene)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (2Z)-2-[(3-HYDROXY-4-METHOXYPHENYL)METHYLIDENE]-7-METHYL-5-[4-(METHYLSULFANYL)PHENYL]-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C25H24N2O5S2 |
|---|---|
| Molecular Weight | 496.11 g/mol |
| LogP | 3.2344 |
| Topological Polar Surface Area | 90.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.11267 |
| Heavy Atoms | 34 |
| Complexity | 1451.8921 |
Chemical Identifiers
| CAS Number | 292641-79-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)/C(=C/C4=CC(=C(C=C4)OC)O)/S2)C |
Product Overview
ChemDiv1_004252 (CAS 292641-79-3), with molecular formula C25H24N2O5S2 and molecular weight 496.11 g/mol. IUPAC: ethyl (2Z)-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of ChemDiv1_004252
Property Insights of ChemDiv1_004252
The XLogP value of 3.2344 indicates that ChemDiv1_004252 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.12 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004252. Following Lipinski's Rule of Five, ChemDiv1_004252 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 ChemDiv1_004252?
The CAS number of ChemDiv1_004252 is 292641-79-3.
What is the molecular formula of ChemDiv1_004252?
The molecular formula of ChemDiv1_004252 is C25H24N2O5S2.
What is the molecular weight of ChemDiv1_004252?
The molecular weight of ChemDiv1_004252 is 496.11 g/mol.
Where can I buy ChemDiv1_004252?
You can request a quote for ChemDiv1_004252 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004252?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004252 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.