BAS 00664347
TL;DR: BAS 00664347 (CAS 314046-13-4) is a chemical compound with molecular formula C27H26N2O6S and molecular weight 506.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-[(4-acetyloxy-3-ethoxyphenyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00664347, ethyl (2E)-2-[4-(acetyloxy)-3-ethoxybenzylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (E)-ethyl 2-(4-acetoxy-3-ethoxybenzylidene)-7-methyl-3-oxo-5-phenyl-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, 2-ethoxy-4-{[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-phenyl(4,5-dihydro-1,3-thiazo lidino[3,2-a]pyrimidin-2-ylidene)]methyl}phenyl acetate, ethyl (2E)-2-[(4-acetyloxy-3-ethoxyphenyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C27H26N2O6S |
|---|---|
| Molecular Weight | 506.15 g/mol |
| LogP | 3.1223 |
| Topological Polar Surface Area | 96.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 506.15115 |
| Heavy Atoms | 36 |
| Complexity | 1517.7709 |
Chemical Identifiers
| CAS Number | 314046-13-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C/2\C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=CC=C4)OC(=O)C |
Product Overview
BAS 00664347 (CAS 314046-13-4), with molecular formula C27H26N2O6S and molecular weight 506.15 g/mol. IUPAC: ethyl (2E)-2-[(4-acetyloxy-3-ethoxyphenyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00664347
Property Insights of BAS 00664347
The XLogP value of 3.1223 indicates that BAS 00664347 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00664347. Following Lipinski's Rule of Five, BAS 00664347 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 BAS 00664347?
The CAS number of BAS 00664347 is 314046-13-4.
What is the molecular formula of BAS 00664347?
The molecular formula of BAS 00664347 is C27H26N2O6S.
What is the molecular weight of BAS 00664347?
The molecular weight of BAS 00664347 is 506.15 g/mol.
Where can I buy BAS 00664347?
You can request a quote for BAS 00664347 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00664347?
Yes, KEHONG BIO provides custom synthesis services for BAS 00664347 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.