![4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one structure](/static/products/6729/672935-41-0.webp)
4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one
TL;DR: 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one (CAS 672935-41-0) is a chemical compound with molecular formula C17H16N4O4 and molecular weight 340.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-hydroxypropylamino)-3-nitrophenyl]-2H-phthalazin-1-one
Also Known As: 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one, AB01292776-01, 4-[4-(2-hydroxypropylamino)-3-nitrophenyl]-2H-phthalazin-1-one, 4-(4-((2-hydroxypropyl)amino)-3-nitrophenyl)phthalazin-1(2H)-one
| Molecular Formula | C17H16N4O4 |
|---|---|
| Molecular Weight | 340.12 g/mol |
| LogP | 2.291 |
| Topological Polar Surface Area | 121.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.11716 |
| Heavy Atoms | 25 |
| Complexity | 997.34955 |
Chemical Identifiers
| CAS Number | 672935-41-0 |
|---|---|
| SMILES | CC(CNC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-])O |
Product Overview
4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one (CAS 672935-41-0), with molecular formula C17H16N4O4 and molecular weight 340.12 g/mol. IUPAC: 4-[4-(2-hydroxypropylamino)-3-nitrophenyl]-2H-phthalazin-1-one.
Chemical Property Profile of 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one
Property Insights of 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one
The XLogP value of 2.291 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one. The TPSA of 121.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one. Following Lipinski's Rule of Five, 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one has 3 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 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one?
The CAS number of 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one is 672935-41-0.
What is the molecular formula of 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one?
The molecular formula of 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one is C17H16N4O4.
What is the molecular weight of 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one?
The molecular weight of 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one is 340.12 g/mol.
Where can I buy 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one?
You can request a quote for 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.