![6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] structure](/static/products/304/304480-92-0.png)
6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]
TL;DR: 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] (CAS 304480-92-0) is a chemical compound with molecular formula C17H15BrN4OS and molecular weight 402.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6-bromo-2-hydroxy-5-methyl-1H-indol-3-yl)imino]-3-(4-methylphenyl)thiourea
Also Known As: 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone], AN-329/40239187, A2022/0084837, 1-[(6-bromo-5-methyl-2-oxoindol-3-yl)amino]-3-(4-methylphenyl)thiourea, (3Z)-6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]
| Molecular Formula | C17H15BrN4OS |
|---|---|
| Molecular Weight | 402.01 g/mol |
| LogP | 5.73354 |
| Topological Polar Surface Area | 72.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 402.01498 |
| Heavy Atoms | 24 |
| Complexity | 947.3741 |
Chemical Identifiers
| CAS Number | 304480-92-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)N=NC2=C(NC3=C2C=C(C(=C3)Br)C)O |
Product Overview
6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] (CAS 304480-92-0), with molecular formula C17H15BrN4OS and molecular weight 402.01 g/mol. IUPAC: 1-[(6-bromo-2-hydroxy-5-methyl-1H-indol-3-yl)imino]-3-(4-methylphenyl)thiourea.
Chemical Property Profile of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]
Property Insights of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]
The XLogP value of 5.73354 indicates that 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]. Following Lipinski's Rule of Five, 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]?
The CAS number of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] is 304480-92-0.
What is the molecular formula of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]?
The molecular formula of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] is C17H15BrN4OS.
What is the molecular weight of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]?
The molecular weight of 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] is 402.01 g/mol.
Where can I buy 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]?
You can request a quote for 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone]?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-5-methyl-1H-indole-2,3-dione 3-[N-(4-methylphenyl)thiosemicarbazone] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.