![2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione structure](/static/products/1004/100440-87-7.webp)
2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione
TL;DR: 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione (CAS 100440-87-7) is a chemical compound with molecular formula C19H16N2O3 and molecular weight 320.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione
Also Known As: 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione, 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11(2H)-trione, 2-(tert-butyl)-1H-naphtho[2,3-g]indazole-3,6,11(2H)-trione
| Molecular Formula | C19H16N2O3 |
|---|---|
| Molecular Weight | 320.12 g/mol |
| LogP | 2.86 |
| Topological Polar Surface Area | 71.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 320.1161 |
| Heavy Atoms | 24 |
| Complexity | 1093.9779 |
Chemical Identifiers
| CAS Number | 100440-87-7 |
|---|---|
| SMILES | CC(C)(C)N1C(=O)C2=C(N1)C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O |
Product Overview
2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione (CAS 100440-87-7), with molecular formula C19H16N2O3 and molecular weight 320.12 g/mol. IUPAC: 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione.
Chemical Property Profile of 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione
Property Insights of 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione
The XLogP value of 2.86 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione. The TPSA of 71.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione. Following Lipinski's Rule of Five, 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione has 1 hydrogen bond donor(s) and 3 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 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione?
The CAS number of 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione is 100440-87-7.
What is the molecular formula of 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione?
The molecular formula of 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione is C19H16N2O3.
What is the molecular weight of 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione?
The molecular weight of 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione is 320.12 g/mol.
Where can I buy 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione?
You can request a quote for 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione?
Yes, KEHONG BIO provides custom synthesis services for 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.