BAS 00663663
TL;DR: BAS 00663663 (CAS 313965-80-9) is a chemical compound with molecular formula C27H20Cl2N2O4S and molecular weight 538.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00663663, ethyl (2E)-2-{[5-(2,4-dichlorophenyl)-2-furyl]methylene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (E)-ethyl 2-((5-(2,4-dichlorophenyl)furan-2-yl)methylene)-7-methyl-3-oxo-5-phenyl-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2E)-2-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 2-{[5-(2,4-dichlorophenyl)(2-furyl)]methylene}-7-methyl-3-oxo-5-phenyl-4 ,5-dihydro-1,3-thiazolidino[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C27H20Cl2N2O4S |
|---|---|
| Molecular Weight | 538.05 g/mol |
| LogP | 5.3651 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 538.05206 |
| Heavy Atoms | 36 |
| Complexity | 1682.4999 |
Chemical Identifiers
| CAS Number | 313965-80-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)/C(=C\C4=CC=C(O4)C5=C(C=C(C=C5)Cl)Cl)/S2)C |
Product Overview
BAS 00663663 (CAS 313965-80-9), with molecular formula C27H20Cl2N2O4S and molecular weight 538.05 g/mol. IUPAC: ethyl (2E)-2-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00663663
Property Insights of BAS 00663663
The XLogP value of 5.3651 indicates that BAS 00663663 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00663663. Following Lipinski's Rule of Five, BAS 00663663 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00663663?
The CAS number of BAS 00663663 is 313965-80-9.
What is the molecular formula of BAS 00663663?
The molecular formula of BAS 00663663 is C27H20Cl2N2O4S.
What is the molecular weight of BAS 00663663?
The molecular weight of BAS 00663663 is 538.05 g/mol.
Where can I buy BAS 00663663?
You can request a quote for BAS 00663663 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00663663?
Yes, KEHONG BIO provides custom synthesis services for BAS 00663663 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.