(5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
TL;DR: (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one (CAS 845901-37-3) is a chemical compound with molecular formula C23H17N3O2S and molecular weight 399.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one, (E)-5-((2H-chromen-3-yl)methylene)-2-((E)-4-methylstyryl)thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
| Molecular Formula | C23H17N3O2S |
|---|---|
| Molecular Weight | 399.10 g/mol |
| LogP | 3.60522 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.10416 |
| Heavy Atoms | 29 |
| Complexity | 1378.0146 |
Chemical Identifiers
| CAS Number | 845901-37-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C/C2=NN3C(=O)/C(=C\C4=CC5=CC=CC=C5OC4)/SC3=N2 |
Product Overview
(5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one (CAS 845901-37-3), with molecular formula C23H17N3O2S and molecular weight 399.10 g/mol. IUPAC: (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Property Insights of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
The XLogP value of 3.60522 indicates that (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.49 Ų, (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
The CAS number of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is 845901-37-3.
What is the molecular formula of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
The molecular formula of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is C23H17N3O2S.
What is the molecular weight of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
The molecular weight of (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is 399.10 g/mol.
Where can I buy (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
You can request a quote for (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-(4-methylphenyl)ethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.