AN-648/12904027
TL;DR: AN-648/12904027 (CAS 357222-90-3) is a chemical compound with molecular formula C26H26ClN3O4S and molecular weight 511.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-5-(4-chlorophenyl)-7-methyl-3-oxo-2-[(5-piperidin-1-ylfuran-2-yl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AN-648/12904027, ethyl (2Z)-5-(4-chlorophenyl)-7-methyl-3-oxo-2-[(5-piperidin-1-ylfuran-2-yl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-5-(4-chlorophenyl)-7-methyl-3-oxo-2-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-ethyl 5-(4-chlorophenyl)-7-methyl-3-oxo-2-((5-(piperidin-1-yl)furan-2-yl)methylene)-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 5-(4-chlorophenyl)-7-methyl-3-oxo-2-{[5-(1-piperidinyl)-2-furyl]methylene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C26H26ClN3O4S |
|---|---|
| Molecular Weight | 511.13 g/mol |
| LogP | 4.035 |
| Topological Polar Surface Area | 77.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 511.13327 |
| Heavy Atoms | 35 |
| Complexity | 1459.2252 |
Chemical Identifiers
| CAS Number | 357222-90-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)/C(=C/C4=CC=C(O4)N5CCCCC5)/S2)C |
Product Overview
AN-648/12904027 (CAS 357222-90-3), with molecular formula C26H26ClN3O4S and molecular weight 511.13 g/mol. IUPAC: ethyl (2Z)-5-(4-chlorophenyl)-7-methyl-3-oxo-2-[(5-piperidin-1-ylfuran-2-yl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AN-648/12904027
Property Insights of AN-648/12904027
The XLogP value of 4.035 indicates that AN-648/12904027 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/12904027. Following Lipinski's Rule of Five, AN-648/12904027 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-648/12904027?
The CAS number of AN-648/12904027 is 357222-90-3.
What is the molecular formula of AN-648/12904027?
The molecular formula of AN-648/12904027 is C26H26ClN3O4S.
What is the molecular weight of AN-648/12904027?
The molecular weight of AN-648/12904027 is 511.13 g/mol.
Where can I buy AN-648/12904027?
You can request a quote for AN-648/12904027 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/12904027?
Yes, KEHONG BIO provides custom synthesis services for AN-648/12904027 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.