2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide
TL;DR: 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide (CAS 732271-46-4) is a chemical compound with molecular formula C20H22BrN3O3 and molecular weight 431.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide
Also Known As: 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide, 3-Bromo-N-(1,2,3,4-tetrahydro-1,4-dioxo-5-phthalazinyl)tricyclo[3.3.1.13,7]decane-1-acetamide, 2-(3-Bromoadamantan-1-yl)-N-(1,4-dioxo-1,2,3,4-tetrahydrophthalazin-5-yl)acetamide
| Molecular Formula | C20H22BrN3O3 |
|---|---|
| Molecular Weight | 431.08 g/mol |
| LogP | 3.2789 |
| Topological Polar Surface Area | 94.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 431.08444 |
| Heavy Atoms | 27 |
| Complexity | 1042.3534 |
Chemical Identifiers
| CAS Number | 732271-46-4 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NC4=CC=CC5=C4C(=O)NNC5=O |
Product Overview
2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide (CAS 732271-46-4), with molecular formula C20H22BrN3O3 and molecular weight 431.08 g/mol. IUPAC: 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide.
Chemical Property Profile of 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide
Property Insights of 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide
The XLogP value of 3.2789 indicates that 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide. Following Lipinski's Rule of Five, 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide has 3 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-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide?
The CAS number of 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide is 732271-46-4.
What is the molecular formula of 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide?
The molecular formula of 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide is C20H22BrN3O3.
What is the molecular weight of 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide?
The molecular weight of 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide is 431.08 g/mol.
Where can I buy 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide?
You can request a quote for 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide 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)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-bromo-1-adamantyl)-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.