(E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine
TL;DR: (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine (CAS 340216-90-2) is a chemical compound with molecular formula C18H15N5OS2 and molecular weight 381.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]-N-(1,2,4-triazol-1-yl)methanimine
Also Known As: (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine, 1-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]-N-(1,2,4-triazol-1-yl)methanimine, N-[(E)-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene]-1H-1,2,4-triazol-1-amine
| Molecular Formula | C18H15N5OS2 |
|---|---|
| Molecular Weight | 381.07 g/mol |
| LogP | 4.0709 |
| Topological Polar Surface Area | 65.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 381.0718 |
| Heavy Atoms | 26 |
| Complexity | 1009.8699 |
Chemical Identifiers
| CAS Number | 340216-90-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=N/N2C=NC=N2)CSC3=NC4=CC=CC=C4S3 |
Product Overview
(E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine (CAS 340216-90-2), with molecular formula C18H15N5OS2 and molecular weight 381.07 g/mol. IUPAC: (E)-1-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]-N-(1,2,4-triazol-1-yl)methanimine.
Chemical Property Profile of (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine
Property Insights of (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine
The XLogP value of 4.0709 indicates that (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine. Following Lipinski's Rule of Five, (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine has 0 hydrogen bond donor(s) and 7 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 (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine?
The CAS number of (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine is 340216-90-2.
What is the molecular formula of (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine?
The molecular formula of (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine is C18H15N5OS2.
What is the molecular weight of (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine?
The molecular weight of (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine is 381.07 g/mol.
Where can I buy (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine?
You can request a quote for (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methoxybenzylidene)-1H-1,2,4-triazol-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.