![(5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium structure](/static/products/128/1286743-39-2.png)
(5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium
TL;DR: (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium (CAS 1286743-39-2) is a chemical compound with molecular formula C15H17BrN3O3S+ and molecular weight 398.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium
Also Known As: (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium
| Molecular Formula | C15H17BrN3O3S+ |
|---|---|
| Molecular Weight | 398.02 g/mol |
| LogP | 2.38062 |
| Topological Polar Surface Area | 76.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.0174 |
| Heavy Atoms | 23 |
| Complexity | 732.5072 |
Chemical Identifiers
| CAS Number | 1286743-39-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=C(S2)Br |
Product Overview
(5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium (CAS 1286743-39-2), with molecular formula C15H17BrN3O3S+ and molecular weight 398.02 g/mol. IUPAC: (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium.
Chemical Property Profile of (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium
Property Insights of (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium
The XLogP value of 2.38062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium. The TPSA of 76.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium. Following Lipinski's Rule of Five, (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium has 2 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-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium?
The CAS number of (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium is 1286743-39-2.
What is the molecular formula of (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium?
The molecular formula of (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium is C15H17BrN3O3S+.
What is the molecular weight of (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium?
The molecular weight of (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium is 398.02 g/mol.
Where can I buy (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium?
You can request a quote for (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium?
Yes, KEHONG BIO provides custom synthesis services for (5-bromothiophen-2-yl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.