N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide
TL;DR: N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide (CAS 1004510-01-3) is a chemical compound with molecular formula C16H12BrN3O2 and molecular weight 357.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-bromophenyl)-2-(1-oxophthalazin-2-yl)acetamide
Also Known As: N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide, N-(3-bromophenyl)-2-(1-oxophthalazin-2-yl)acetamide
| Molecular Formula | C16H12BrN3O2 |
|---|---|
| Molecular Weight | 357.01 g/mol |
| LogP | 2.7977 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.0113 |
| Heavy Atoms | 22 |
| Complexity | 905.03156 |
Chemical Identifiers
| CAS Number | 1004510-01-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NC3=CC(=CC=C3)Br |
Product Overview
N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide (CAS 1004510-01-3), with molecular formula C16H12BrN3O2 and molecular weight 357.01 g/mol. IUPAC: N-(3-bromophenyl)-2-(1-oxophthalazin-2-yl)acetamide.
Chemical Property Profile of N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide
Property Insights of N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide
The XLogP value of 2.7977 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide. Following Lipinski's Rule of Five, N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide 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 N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide?
The CAS number of N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide is 1004510-01-3.
What is the molecular formula of N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide?
The molecular formula of N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide is C16H12BrN3O2.
What is the molecular weight of N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide?
The molecular weight of N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide is 357.01 g/mol.
Where can I buy N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide?
You can request a quote for N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromophenyl)-2-(1-oxophthalazin-2(1H)-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.