3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide
TL;DR: 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide (CAS 1090362-46-1) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.1634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide
Also Known As: 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide, AB00867490-06, 3-benzyl-N,N-diethyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Technical Specifications
| Molecular Formula | C20H21N3O2 |
| Molecular Weight | 335.1634 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.1634 Da |
| Heavy Atoms | 25 |
| Complexity | 521.0 |
| SMILES | CCN(CC)C(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3 |
| InChIKey | WBARMPDEFHPSDI-UHFFFAOYSA-N |
Chemical Property Profile of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide
Property Insights of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide
The XLogP value of 3.0 indicates that 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide?
The CAS number of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide is 1090362-46-1.
What is the molecular formula of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide?
The molecular formula of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide is C20H21N3O2.
What is the molecular weight of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide?
The molecular weight of 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide is 335.1634 g/mol.
Where can I buy 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide?
You can request a quote for 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide?
Yes, CoreyChem provides custom synthesis services for 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.