N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide
TL;DR: N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide (CAS 836626-00-7) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-oxo-4-phenylphthalazin-2-yl)-N-propan-2-ylpropanamide
Also Known As: N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide, 3-(1-oxo-4-phenylphthalazin-2-yl)-N-propan-2-ylpropanamide, 3-(1-oxo-4-phenylphthalazin-2(1H)-yl)-N-(propan-2-yl)propanamide
| Molecular Formula | C20H21N3O2 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 2.9782 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.1634 |
| Heavy Atoms | 25 |
| Complexity | 946.06256 |
Chemical Identifiers
| CAS Number | 836626-00-7 |
|---|---|
| SMILES | CC(C)NC(=O)CCN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=CC=C3 |
Product Overview
N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide (CAS 836626-00-7), with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol. IUPAC: 3-(1-oxo-4-phenylphthalazin-2-yl)-N-propan-2-ylpropanamide.
Chemical Property Profile of N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide
Property Insights of N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide
The XLogP value of 2.9782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide. Following Lipinski's Rule of Five, N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide 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-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide?
The CAS number of N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide is 836626-00-7.
What is the molecular formula of N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide?
The molecular formula of N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide is C20H21N3O2.
What is the molecular weight of N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide?
The molecular weight of N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide is 335.16 g/mol.
Where can I buy N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide?
You can request a quote for N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-isopropyl-3-(1-oxo-4-phenylphthalazin-2(1H)-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.