![2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole structure](/static/products/1098/109807-40-1.webp)
2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole
TL;DR: 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole (CAS 109807-40-1) is a chemical compound with molecular formula C18H15NS and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole
Also Known As: BAS 00090074, 2-methyl-6-(4-phenyl-1,3-butadienyl)-1,3-benzothiazole, 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole, 2-Methyl-6-(4-phenyl-buta-1,3-dienyl)-benzothiazole, BRD-K78875681-001-01-1
| Molecular Formula | C18H15NS |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 5.33132 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.09253 |
| Heavy Atoms | 20 |
| Complexity | 766.47235 |
Chemical Identifiers
| CAS Number | 109807-40-1 |
|---|---|
| SMILES | CC1=NC2=C(S1)C=C(C=C2)/C=C/C=C/C3=CC=CC=C3 |
Product Overview
2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole (CAS 109807-40-1), with molecular formula C18H15NS and molecular weight 277.09 g/mol. IUPAC: 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole.
Chemical Property Profile of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole
Property Insights of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole
The XLogP value of 5.33132 indicates that 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole?
The CAS number of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole is 109807-40-1.
What is the molecular formula of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole?
The molecular formula of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole is C18H15NS.
What is the molecular weight of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole?
The molecular weight of 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole is 277.09 g/mol.
Where can I buy 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole?
You can request a quote for 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-6-[(1E,3E)-4-phenylbuta-1,3-dienyl]-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.