![2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione structure](/static/products/3260/326018-27-3.webp)
2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione
TL;DR: 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione (CAS 326018-27-3) is a chemical compound with molecular formula C19H19BrN2O4 and molecular weight 418.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione
Also Known As: 2-[(3-bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione, F0020-1718, 2-[(3-bromoadamantanyl)methyl]-5-nitrobenzo[c]azoline-1,3-dione, 2-[(3-bromoadamantan-1-yl)methyl]-5-nitro-2,3-dihydro-1H-isoindole-1,3-dione, 2-[(3-bromo-1-adamantanyl)methyl]-5-nitro-1,3-isoindolinedione
| Molecular Formula | C19H19BrN2O4 |
|---|---|
| Molecular Weight | 418.05 g/mol |
| LogP | 3.9247 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.05283 |
| Heavy Atoms | 26 |
| Complexity | 853.09515 |
Chemical Identifiers
| CAS Number | 326018-27-3 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)Br)CN4C(=O)C5=C(C4=O)C=C(C=C5)[N+](=O)[O-] |
Product Overview
2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione (CAS 326018-27-3), with molecular formula C19H19BrN2O4 and molecular weight 418.05 g/mol. IUPAC: 2-[(3-bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione.
Chemical Property Profile of 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione
Property Insights of 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione
The XLogP value of 3.9247 indicates that 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione. Following Lipinski's Rule of Five, 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-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 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione?
The CAS number of 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione is 326018-27-3.
What is the molecular formula of 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione?
The molecular formula of 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione is C19H19BrN2O4.
What is the molecular weight of 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione?
The molecular weight of 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione is 418.05 g/mol.
Where can I buy 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione?
You can request a quote for 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Bromo-1-adamantyl)methyl]-5-nitroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.