TL;DR: (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 300386-52-1) is a chemical compound with molecular formula C28H24N2O4S and molecular weight 484.1457 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-[[3-methoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one, (2E)-2-[[3-methoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
| Molecular Formula | C28H24N2O4S |
| Molecular Weight | 484.1457 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 87.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 484.1457 Da |
| Heavy Atoms | 35 |
| Complexity | 776.0 |
| SMILES | COC1=C(C=CC(=C1)/C=C/2\C(=O)N3C4=CC=CC=C4N=C3S2)OCCOC5=CC=CC=C5CC=C |
| InChIKey | AFFULCZSVHUZOD-NLRVBDNBSA-N |
The XLogP value of 6.8 indicates that (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one. Following Lipinski's Rule of Five, (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 300386-52-1.
The molecular formula of (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is C28H24N2O4S.
The molecular weight of (E)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 484.1457 g/mol.
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