AN-758/13190064
TL;DR: AN-758/13190064 (CAS 354785-01-6) is a chemical compound with molecular formula C31H26N2O5S and molecular weight 538.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-7-methyl-2-[[4-(3-methylbenzoyl)oxyphenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AN-758/13190064, ethyl (2Z)-7-methyl-2-[[4-(3-methylbenzoyl)oxyphenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 7-methyl-2-{4-[(3-methylbenzoyl)oxy]benzylidene}-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z,5R)-7-methyl-2-[[4-(3-methylbenzoyl)oxyphenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C31H26N2O5S |
|---|---|
| Molecular Weight | 538.16 g/mol |
| LogP | 4.32592 |
| Topological Polar Surface Area | 86.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 538.15625 |
| Heavy Atoms | 39 |
| Complexity | 1766.1302 |
Chemical Identifiers
| CAS Number | 354785-01-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC=C(C=C4)OC(=O)C5=CC=CC(=C5)C)/S2)C |
Product Overview
AN-758/13190064 (CAS 354785-01-6), with molecular formula C31H26N2O5S and molecular weight 538.16 g/mol. IUPAC: ethyl (2Z)-7-methyl-2-[[4-(3-methylbenzoyl)oxyphenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AN-758/13190064
Property Insights of AN-758/13190064
The XLogP value of 4.32592 indicates that AN-758/13190064 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-758/13190064. Following Lipinski's Rule of Five, AN-758/13190064 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-758/13190064?
The CAS number of AN-758/13190064 is 354785-01-6.
What is the molecular formula of AN-758/13190064?
The molecular formula of AN-758/13190064 is C31H26N2O5S.
What is the molecular weight of AN-758/13190064?
The molecular weight of AN-758/13190064 is 538.16 g/mol.
Where can I buy AN-758/13190064?
You can request a quote for AN-758/13190064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-758/13190064?
Yes, KEHONG BIO provides custom synthesis services for AN-758/13190064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.