RefChem:592973
TL;DR: RefChem:592973 (CAS 324568-13-0) is a chemical compound with molecular formula C29H31N3O5S and molecular weight 533.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-5-(4-acetyloxyphenyl)-2-[[4-(diethylamino)phenyl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00781023, ethyl (2E)-5-[4-(acetyloxy)phenyl]-2-[4-(diethylamino)benzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2E)-5-(4-acetyloxyphenyl)-2-[[4-(diethylamino)phenyl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, Ethyl 5-(4-acetoxyphenyl)-2-(4-(diethylamino)benzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, 651-542-5
| Molecular Formula | C29H31N3O5S |
|---|---|
| Molecular Weight | 533.20 g/mol |
| LogP | 3.5698 |
| Topological Polar Surface Area | 90.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 533.1984 |
| Heavy Atoms | 38 |
| Complexity | 1545.3579 |
Chemical Identifiers
| CAS Number | 324568-13-0 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=C/2\C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=C(C=C4)OC(=O)C |
Product Overview
RefChem:592973 (CAS 324568-13-0), with molecular formula C29H31N3O5S and molecular weight 533.20 g/mol. IUPAC: ethyl (2E)-5-(4-acetyloxyphenyl)-2-[[4-(diethylamino)phenyl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of RefChem:592973
Property Insights of RefChem:592973
The XLogP value of 3.5698 indicates that RefChem:592973 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:592973. Following Lipinski's Rule of Five, RefChem:592973 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:592973?
The CAS number of RefChem:592973 is 324568-13-0.
What is the molecular formula of RefChem:592973?
The molecular formula of RefChem:592973 is C29H31N3O5S.
What is the molecular weight of RefChem:592973?
The molecular weight of RefChem:592973 is 533.20 g/mol.
Where can I buy RefChem:592973?
You can request a quote for RefChem:592973 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:592973?
Yes, KEHONG BIO provides custom synthesis services for RefChem:592973 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.