2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one
TL;DR: 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one (CAS 61632-64-2) is a chemical compound with molecular formula C11H11N3O and molecular weight 201.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one
Also Known As: 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one, J2.651.408H, 1,2-(Epiminopropano)-4-oxylatophthalazine-2-ium, 3,4-Dihydro-2H-pyrimido[2,1-a]phthalazin-7(6H)-one, 2H-Pyrimido(2,1-a)phthalazine, 7-oxo-3,4,6,7-tetrahydro-
| Molecular Formula | C11H11N3O |
|---|---|
| Molecular Weight | 201.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.09021 |
| Heavy Atoms | 15 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 61632-64-2 |
|---|---|
| SMILES | C1CN=C2C3=CC=CC=C3C(=O)NN2C1 |
| InChIKey | JPWAMCDHIJELTE-UHFFFAOYSA-N |
Product Overview
2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one (CAS 61632-64-2), with molecular formula C11H11N3O and molecular weight 201.09 g/mol. IUPAC: 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one.
Chemical Property Profile of 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one
Property Insights of 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one. With a topological polar surface area (TPSA) of 44.7 Ų, 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one has 1 hydrogen bond donor(s) and 2 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 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one?
The CAS number of 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one is 61632-64-2.
What is the molecular formula of 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one?
The molecular formula of 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one is C11H11N3O.
What is the molecular weight of 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one?
The molecular weight of 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one is 201.09 g/mol.
Where can I buy 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one?
You can request a quote for 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,6-tetrahydropyrimido[2,1-a]phthalazin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.