6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole
TL;DR: 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole (CAS 24338-09-8) is a chemical compound with molecular formula C11H11N3O2S and molecular weight 249.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-1-(prop-2-enylsulfanylmethyl)indazole
Also Known As: 6-nitro-1-(prop-2-enylsulfanylmethyl)indazole, 6-nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole, 1H-Indazole,6-nitro-1-[(2-propen-1-ylthio)methyl]-, 6-Nitro-1-{[(prop-2-en-1-yl)sulfanyl]methyl}-1H-indazole
| Molecular Formula | C11H11N3O2S |
|---|---|
| Molecular Weight | 249.06 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.0572 |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 24338-09-8 |
|---|---|
| SMILES | C=CCSCN1C2=C(C=CC(=C2)[N+](=O)[O-])C=N1 |
| InChIKey | FSTZKKUNVZBYOX-UHFFFAOYSA-N |
Product Overview
6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole (CAS 24338-09-8), with molecular formula C11H11N3O2S and molecular weight 249.06 g/mol. IUPAC: 6-nitro-1-(prop-2-enylsulfanylmethyl)indazole.
Chemical Property Profile of 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole
Property Insights of 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole
The XLogP value of 3.3 indicates that 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole. Following Lipinski's Rule of Five, 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole 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 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole?
The CAS number of 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole is 24338-09-8.
What is the molecular formula of 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole?
The molecular formula of 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole is C11H11N3O2S.
What is the molecular weight of 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole?
The molecular weight of 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole is 249.06 g/mol.
Where can I buy 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole?
You can request a quote for 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitro-1-[(prop-2-en-1-ylsulfanyl)methyl]-1h-indazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.