4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde
TL;DR: 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde (CAS 10476-16-1) is a chemical compound with molecular formula C10H7BrOS and molecular weight 253.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-7-methyl-1-benzothiophene-3-carbaldehyde
Also Known As: 4-Bromo-7-methyl-1-benzothiophene-3-carbaldehyde, 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde, 4-Bromo-7-methylbenzothiophene-3-carbaldehyde, J1.426.601A, 4-Bromo-7-methylbenzo[b]thiophene-3-carbaldehyde
| Molecular Formula | C10H7BrOS |
|---|---|
| Molecular Weight | 253.94 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.9401 |
| Heavy Atoms | 13 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 10476-16-1 |
|---|---|
| SMILES | CC1=C2C(=C(C=C1)Br)C(=CS2)C=O |
| InChIKey | MZAUKGIENYNOMU-UHFFFAOYSA-N |
Product Overview
4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde (CAS 10476-16-1), with molecular formula C10H7BrOS and molecular weight 253.94 g/mol. IUPAC: 4-bromo-7-methyl-1-benzothiophene-3-carbaldehyde.
Chemical Property Profile of 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde
Property Insights of 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde
The XLogP value of 3.5 indicates that 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde has 0 hydrogen bond donor(s) and 2 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 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde?
The CAS number of 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde is 10476-16-1.
What is the molecular formula of 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde?
The molecular formula of 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde is C10H7BrOS.
What is the molecular weight of 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde?
The molecular weight of 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde is 253.94 g/mol.
Where can I buy 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde?
You can request a quote for 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-7-methylbenzo(b)thiophene-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.