N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide
TL;DR: N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide (CAS 23952-08-1) is a chemical compound with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-oxo-3H-phthalazine-1-carboxamide
Also Known As: SDCCGMLS-0064418.P001, N,N-diethyl-4-oxo-3H-phthalazine-1-carboxamide, N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide, N,N-Diethyl-3,4-dihydro-4-oxo-1-phthalazinecarboxamide, N,N-diethyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
| Molecular Formula | C13H15N3O2 |
|---|---|
| Molecular Weight | 245.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.11642 |
| Heavy Atoms | 18 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 23952-08-1 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=NNC(=O)C2=CC=CC=C21 |
| InChIKey | NGCUFROJYDOAAR-UHFFFAOYSA-N |
Product Overview
N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide (CAS 23952-08-1), with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol. IUPAC: N,N-diethyl-4-oxo-3H-phthalazine-1-carboxamide.
Chemical Property Profile of N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide
Property Insights of N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide. Following Lipinski's Rule of Five, N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide 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-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide?
The CAS number of N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide is 23952-08-1.
What is the molecular formula of N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide?
The molecular formula of N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide is C13H15N3O2.
What is the molecular weight of N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide?
The molecular weight of N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide is 245.12 g/mol.
Where can I buy N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide?
You can request a quote for N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-4-oxo-3,4-dihydro-1-phthalazinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.