![6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione structure](/static/products/809/80944-69-0.png)
6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione
TL;DR: 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione (CAS 80944-69-0) is a chemical compound with molecular formula C13H18N4O2 and molecular weight 262.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-aminobutyl(methyl)amino]-2,3-dihydrophthalazine-1,4-dione
Also Known As: NCI60_006489, 6-[(4-aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione, 6-[4-aminobutyl(methyl)amino]-2,3-dihydrophthalazine-1,4-dione, 6-[(4-Aminobutyl)methylamino]phthalazine-1,4(2H,3H)-dione, 1,4-Phthalazinedione, 6-[(4-aminobutyl)methylamino]-2,3-dihydro-
| Molecular Formula | C13H18N4O2 |
|---|---|
| Molecular Weight | 262.14 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.14297 |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 80944-69-0 |
|---|---|
| SMILES | CN(CCCCN)C1=CC2=C(C=C1)C(=O)NNC2=O |
| InChIKey | NVOWEQPSRQXFQE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione (CAS 80944-69-0), with molecular formula C13H18N4O2 and molecular weight 262.14 g/mol. IUPAC: 6-[4-aminobutyl(methyl)amino]-2,3-dihydrophthalazine-1,4-dione.
Chemical Property Profile of 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione
Property Insights of 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione. Following Lipinski's Rule of Five, 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione has 3 hydrogen bond donor(s) and 4 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 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione?
The CAS number of 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione is 80944-69-0.
What is the molecular formula of 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione?
The molecular formula of 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione is C13H18N4O2.
What is the molecular weight of 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione?
The molecular weight of 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione is 262.14 g/mol.
Where can I buy 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione?
You can request a quote for 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-[(4-Aminobutyl)(methyl)amino]-2,3-dihydrophthalazine-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.