AN-648/15596071
TL;DR: AN-648/15596071 (CAS 445425-45-6) is a chemical compound with molecular formula C26H25ClN2O5S and molecular weight 512.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(5-chloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-(4-propan-2-yloxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AN-648/15596071, ethyl 2-(5-chloro-2-hydroxybenzylidene)-5-(4-isopropoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-[(5-chloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-(4-propan-2-yloxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-(5-chloro-2-hydroxybenzylidene)-7-methyl-3-oxo-5-[4-(propan-2-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C26H25ClN2O5S |
|---|---|
| Molecular Weight | 512.12 g/mol |
| LogP | 3.9445 |
| Topological Polar Surface Area | 90.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 512.11725 |
| Heavy Atoms | 35 |
| Complexity | 1485.3605 |
Chemical Identifiers
| CAS Number | 445425-45-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC(C)C)C(=O)/C(=C/C4=C(C=CC(=C4)Cl)O)/S2)C |
Product Overview
AN-648/15596071 (CAS 445425-45-6), with molecular formula C26H25ClN2O5S and molecular weight 512.12 g/mol. IUPAC: ethyl (2Z)-2-[(5-chloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-(4-propan-2-yloxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AN-648/15596071
Property Insights of AN-648/15596071
The XLogP value of 3.9445 indicates that AN-648/15596071 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 AN-648/15596071. Following Lipinski's Rule of Five, AN-648/15596071 has 1 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-648/15596071?
The CAS number of AN-648/15596071 is 445425-45-6.
What is the molecular formula of AN-648/15596071?
The molecular formula of AN-648/15596071 is C26H25ClN2O5S.
What is the molecular weight of AN-648/15596071?
The molecular weight of AN-648/15596071 is 512.12 g/mol.
Where can I buy AN-648/15596071?
You can request a quote for AN-648/15596071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/15596071?
Yes, KEHONG BIO provides custom synthesis services for AN-648/15596071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.