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 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide
Also Known As: 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide, 3-benzyl-N,N-diethyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
| Molecular Formula | C20H21N3O2 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 2.9268 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.1634 |
| Heavy Atoms | 25 |
| Complexity | 944.06256 |
Chemical Identifiers
| CAS Number | 1090362-46-1 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3 |
Product Overview
3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide (CAS 1090362-46-1), with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol. IUPAC: 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide.
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 2.9268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide. With a topological polar surface area (TPSA) of 55.2 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
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 335.16 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-N,N-diethyl-4-oxophthalazine-1-carboxamide?
Yes, KEHONG BIO 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.