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2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one
TL;DR: 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one (CAS 664972-89-8) is a chemical compound with molecular formula C19H19N3O and molecular weight 305.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylaminomethyl)-2,3-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,5(16),6,8,10,12,14-heptaen-4-one
Also Known As: ChemDiv3_005422, BAS 09850446, IDI1_023332, CAS 664972-89-8, 2-Diethylaminomethyl-2H-indeno[1,2,3-de]phthalazin-3-one
| Molecular Formula | C19H19N3O |
|---|---|
| Molecular Weight | 305.15 g/mol |
| LogP | 3.3432 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.1528 |
| Heavy Atoms | 23 |
| Complexity | 954.4762 |
Chemical Identifiers
| CAS Number | 664972-89-8 |
|---|---|
| SMILES | CCN(CC)CN1C(=O)C2=C3C(=CC=C2)C4=CC=CC=C4C3=N1 |
Product Overview
2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one (CAS 664972-89-8), with molecular formula C19H19N3O and molecular weight 305.15 g/mol. IUPAC: 3-(diethylaminomethyl)-2,3-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,5(16),6,8,10,12,14-heptaen-4-one.
Chemical Property Profile of 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one
Property Insights of 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one
The XLogP value of 3.3432 indicates that 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one 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 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
The CAS number of 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one is 664972-89-8.
What is the molecular formula of 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
The molecular formula of 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one is C19H19N3O.
What is the molecular weight of 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
The molecular weight of 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one is 305.15 g/mol.
Where can I buy 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
You can request a quote for 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-((diethylamino)methyl)indeno[1,2,3-de]phthalazin-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.