AH-487/11778126
TL;DR: AH-487/11778126 (CAS 351518-95-1) is a chemical compound with molecular formula C30H25N3O6S and molecular weight 555.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-7-methyl-2-[[3-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AH-487/11778126, ETHYL (2Z)-7-METHYL-2-({3-[(4-NITROPHENYL)METHOXY]PHENYL}METHYLIDENE)-3-OXO-5-PHENYL-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE, ethyl (2Z)-7-methyl-2-[[3-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 2-[3-({4-nitrobenzyl}oxy)benzylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-ethyl 7-methyl-2-(3-((4-nitrobenzyl)oxy)benzylidene)-3-oxo-5-phenyl-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C30H25N3O6S |
|---|---|
| Molecular Weight | 555.15 g/mol |
| LogP | 4.2855 |
| Topological Polar Surface Area | 113.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 555.1464 |
| Heavy Atoms | 40 |
| Complexity | 1789.5883 |
Chemical Identifiers
| CAS Number | 351518-95-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC(=CC=C4)OCC5=CC=C(C=C5)[N+](=O)[O-])/S2)C |
Product Overview
AH-487/11778126 (CAS 351518-95-1), with molecular formula C30H25N3O6S and molecular weight 555.15 g/mol. IUPAC: ethyl (2Z)-7-methyl-2-[[3-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AH-487/11778126
Property Insights of AH-487/11778126
The XLogP value of 4.2855 indicates that AH-487/11778126 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.03 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/11778126. Following Lipinski's Rule of Five, AH-487/11778126 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 AH-487/11778126?
The CAS number of AH-487/11778126 is 351518-95-1.
What is the molecular formula of AH-487/11778126?
The molecular formula of AH-487/11778126 is C30H25N3O6S.
What is the molecular weight of AH-487/11778126?
The molecular weight of AH-487/11778126 is 555.15 g/mol.
Where can I buy AH-487/11778126?
You can request a quote for AH-487/11778126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/11778126?
Yes, KEHONG BIO provides custom synthesis services for AH-487/11778126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.