2,3-Dihydro-1,4-phthalazinedione
TL;DR: 2,3-Dihydro-1,4-phthalazinedione (CAS 94020-95-8) is a chemical compound with molecular formula C8H6N2O2 and molecular weight 162.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydrophthalazine-1,4-dione
Also Known As: Phthalhydrazide, 2,3-Dihydrophthalazine-1,4-dione, Phthalic Hydrazide, 1,4-Phthalazinediol, phthalazine-1,4-diol
| Molecular Formula | C8H6N2O2 |
|---|---|
| Molecular Weight | 162.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.04292 |
| Heavy Atoms | 12 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 94020-95-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)NNC2=O |
| InChIKey | KGLPWQKSKUVKMJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Dihydro-1,4-phthalazinedione (CAS 94020-95-8), with molecular formula C8H6N2O2 and molecular weight 162.04 g/mol. IUPAC: 2,3-dihydrophthalazine-1,4-dione.
Chemical Property Profile of 2,3-Dihydro-1,4-phthalazinedione
Property Insights of 2,3-Dihydro-1,4-phthalazinedione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dihydro-1,4-phthalazinedione. With a topological polar surface area (TPSA) of 58.2 Ų, 2,3-Dihydro-1,4-phthalazinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dihydro-1,4-phthalazinedione has 2 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-Dihydro-1,4-phthalazinedione?
The CAS number of 2,3-Dihydro-1,4-phthalazinedione is 94020-95-8.
What is the molecular formula of 2,3-Dihydro-1,4-phthalazinedione?
The molecular formula of 2,3-Dihydro-1,4-phthalazinedione is C8H6N2O2.
What is the molecular weight of 2,3-Dihydro-1,4-phthalazinedione?
The molecular weight of 2,3-Dihydro-1,4-phthalazinedione is 162.04 g/mol.
Where can I buy 2,3-Dihydro-1,4-phthalazinedione?
You can request a quote for 2,3-Dihydro-1,4-phthalazinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydro-1,4-phthalazinedione?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydro-1,4-phthalazinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.