![2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide structure](/static/products/7012/701238-33-7.webp)
2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide
TL;DR: 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide (CAS 701238-33-7) is a chemical compound with molecular formula C21H20N4O5 and molecular weight 408.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide
Also Known As: CBKinase1_006089, CBKinase1_018489, BRD-A52136490-001-01-1, 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide, 2-[4-(3-nitrophenyl)-1-oxophthalazin-2(1H)-yl]-N-(tetrahydrofuran-2-ylmethyl)acetamide
| Molecular Formula | C21H20N4O5 |
|---|---|
| Molecular Weight | 408.14 g/mol |
| LogP | 2.2669 |
| Topological Polar Surface Area | 116.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.14337 |
| Heavy Atoms | 30 |
| Complexity | 1167.5156 |
Chemical Identifiers
| CAS Number | 701238-33-7 |
|---|---|
| SMILES | C1CC(OC1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide (CAS 701238-33-7), with molecular formula C21H20N4O5 and molecular weight 408.14 g/mol. IUPAC: 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide.
Chemical Property Profile of 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide
Property Insights of 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide
The XLogP value of 2.2669 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide. The TPSA of 116.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide. Following Lipinski's Rule of Five, 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide has 1 hydrogen bond donor(s) and 6 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-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
The CAS number of 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide is 701238-33-7.
What is the molecular formula of 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
The molecular formula of 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide is C21H20N4O5.
What is the molecular weight of 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
The molecular weight of 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide is 408.14 g/mol.
Where can I buy 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
You can request a quote for 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.