![5-bromo-3H-benzo[e]indole-2-carboxylic acid structure](/static/products/900/900136-41-6.png)
5-bromo-3H-benzo[e]indole-2-carboxylic acid
TL;DR: 5-bromo-3H-benzo[e]indole-2-carboxylic acid (CAS 900136-41-6) is a chemical compound with molecular formula C13H8BrNO2 and molecular weight 288.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3H-benzo[e]indole-2-carboxylic acid
Also Known As: 5-bromo-3H-benzo[e]indole-2-carboxylic acid, 5-bromo-3H-benzo[e]indole-2-carboxylicacid
| Molecular Formula | C13H8BrNO2 |
|---|---|
| Molecular Weight | 288.97 g/mol |
| LogP | 3.7818 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.97385 |
| Heavy Atoms | 17 |
| Complexity | 745.59393 |
Chemical Identifiers
| CAS Number | 900136-41-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC3=C2C=C(N3)C(=O)O)Br |
Product Overview
5-bromo-3H-benzo[e]indole-2-carboxylic acid (CAS 900136-41-6), with molecular formula C13H8BrNO2 and molecular weight 288.97 g/mol. IUPAC: 5-bromo-3H-benzo[e]indole-2-carboxylic acid.
Chemical Property Profile of 5-bromo-3H-benzo[e]indole-2-carboxylic acid
Property Insights of 5-bromo-3H-benzo[e]indole-2-carboxylic acid
The XLogP value of 3.7818 indicates that 5-bromo-3H-benzo[e]indole-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, 5-bromo-3H-benzo[e]indole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-3H-benzo[e]indole-2-carboxylic acid has 2 hydrogen bond donor(s) and 1 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 5-bromo-3H-benzo[e]indole-2-carboxylic acid?
The CAS number of 5-bromo-3H-benzo[e]indole-2-carboxylic acid is 900136-41-6.
What is the molecular formula of 5-bromo-3H-benzo[e]indole-2-carboxylic acid?
The molecular formula of 5-bromo-3H-benzo[e]indole-2-carboxylic acid is C13H8BrNO2.
What is the molecular weight of 5-bromo-3H-benzo[e]indole-2-carboxylic acid?
The molecular weight of 5-bromo-3H-benzo[e]indole-2-carboxylic acid is 288.97 g/mol.
Where can I buy 5-bromo-3H-benzo[e]indole-2-carboxylic acid?
You can request a quote for 5-bromo-3H-benzo[e]indole-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-3H-benzo[e]indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-3H-benzo[e]indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.