4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione
TL;DR: 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione (CAS 1698-55-1) is a chemical compound with molecular formula C10H7ClN2O2 and molecular weight 222.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-phenyl-1H-pyridazine-3,6-dione
Also Known As: 5-chloro-2-phenyl-1H-pyridazine-3,6-dione, 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione, 1-PHENYL-3-HYDROXY-4-CHLORO-6-PYRIDAZONE, 5-Chloro-6-hydroxy-2-phenylpyridazin-3(2H)-one, 4-chloro-1-phenyl-1,2-dihydropyridazine-3,6-dione
| Molecular Formula | C10H7ClN2O2 |
|---|---|
| Molecular Weight | 222.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.0196 |
| Heavy Atoms | 15 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 1698-55-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C=C(C(=O)N2)Cl |
| InChIKey | ODPNBRBOAQEHKP-UHFFFAOYSA-N |
Product Overview
4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione (CAS 1698-55-1), with molecular formula C10H7ClN2O2 and molecular weight 222.02 g/mol. IUPAC: 5-chloro-2-phenyl-1H-pyridazine-3,6-dione.
Chemical Property Profile of 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione
Property Insights of 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione 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 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione?
The CAS number of 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione is 1698-55-1.
What is the molecular formula of 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione?
The molecular formula of 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione is C10H7ClN2O2.
What is the molecular weight of 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione?
The molecular weight of 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione is 222.02 g/mol.
Where can I buy 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione?
You can request a quote for 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-1,2-dihydro-1-phenylpyridazine-3,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.