2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol
TL;DR: 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol (CAS 315670-77-0) is a chemical compound with molecular formula C12H10BrNOS and molecular weight 294.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-bromothiophen-2-yl)methylideneamino]-4-methylphenol
Also Known As: 2-{[(5-bromo-2-thienyl)methylene]amino}-4-methylphenol, 2-[(5-bromothiophen-2-yl)methylideneamino]-4-methylphenol, AN-329/11482435, (E)-2-(((5-bromothiophen-2-yl)methylene)amino)-4-methylphenol, 2-[(1E)-2-(5-bromo(2-thienyl))-1-azavinyl]-4-methylphenol
| Molecular Formula | C12H10BrNOS |
|---|---|
| Molecular Weight | 294.97 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.96664 |
| Heavy Atoms | 16 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 315670-77-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)N=CC2=CC=C(S2)Br |
| InChIKey | PNUAFVCAFLSUGV-UHFFFAOYSA-N |
Product Overview
2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol (CAS 315670-77-0), with molecular formula C12H10BrNOS and molecular weight 294.97 g/mol. IUPAC: 2-[(5-bromothiophen-2-yl)methylideneamino]-4-methylphenol.
Chemical Property Profile of 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol
Property Insights of 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol
The XLogP value of 4.3 indicates that 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol. Following Lipinski's Rule of Five, 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol has 1 hydrogen bond donor(s) and 3 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 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol?
The CAS number of 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol is 315670-77-0.
What is the molecular formula of 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol?
The molecular formula of 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol is C12H10BrNOS.
What is the molecular weight of 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol?
The molecular weight of 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol is 294.97 g/mol.
Where can I buy 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol?
You can request a quote for 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(5-Bromo-2-thienyl)methylene]amino}-4-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.