N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide
TL;DR: N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide (CAS 333438-92-9) is a chemical compound with molecular formula C17H15N3O2 and molecular weight 293.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide
Also Known As: N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide, SDCCGMLS-0064985.P001, BAS 01890748, 4-(3,4-dihydro-4-oxo-1-phthalazinyl)-N,N-dimethylBenzamide, N,N-dimethyl-4-(4-oxo-3,4-dihydrophthalazin-1-yl)benzamide
| Molecular Formula | C17H15N3O2 |
|---|---|
| Molecular Weight | 293.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.11642 |
| Heavy Atoms | 22 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 333438-92-9 |
|---|---|
| SMILES | CN(C)C(=O)C1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32 |
| InChIKey | PVXUYPLWMVPQAL-UHFFFAOYSA-N |
Product Overview
N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide (CAS 333438-92-9), with molecular formula C17H15N3O2 and molecular weight 293.12 g/mol. IUPAC: N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide.
Chemical Property Profile of N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide
Property Insights of N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide. Following Lipinski's Rule of Five, N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide 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,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide?
The CAS number of N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide is 333438-92-9.
What is the molecular formula of N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide?
The molecular formula of N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide is C17H15N3O2.
What is the molecular weight of N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide?
The molecular weight of N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide is 293.12 g/mol.
Where can I buy N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide?
You can request a quote for N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-4-(4-oxo-3H-phthalazin-1-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.