5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione
TL;DR: 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione (CAS 903860-67-3) is a chemical compound with molecular formula C16H9BrClNO4 and molecular weight 392.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]indole-2,3-dione
Also Known As: 5-bromo-1-((6-chlorobenzo[d][1,3]dioxol-5-yl)methyl)indoline-2,3-dione, 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione, 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]indole-2,3-dione
| Molecular Formula | C16H9BrClNO4 |
|---|---|
| Molecular Weight | 392.94 g/mol |
| LogP | 3.5607 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 392.94034 |
| Heavy Atoms | 23 |
| Complexity | 867.399 |
Chemical Identifiers
| CAS Number | 903860-67-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)CN3C4=C(C=C(C=C4)Br)C(=O)C3=O)Cl |
Product Overview
5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione (CAS 903860-67-3), with molecular formula C16H9BrClNO4 and molecular weight 392.94 g/mol. IUPAC: 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]indole-2,3-dione.
Chemical Property Profile of 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione
Property Insights of 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione
The XLogP value of 3.5607 indicates that 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione has 0 hydrogen bond donor(s) and 4 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-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione?
The CAS number of 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione is 903860-67-3.
What is the molecular formula of 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione?
The molecular formula of 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione is C16H9BrClNO4.
What is the molecular weight of 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione?
The molecular weight of 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione is 392.94 g/mol.
Where can I buy 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione?
You can request a quote for 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.