Nsp 804
TL;DR: Nsp 804 (CAS 125068-43-1) is a chemical compound with molecular formula C16H17N3O2 and molecular weight 283.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-[(2-methyl-3-oxocyclopenten-1-yl)amino]phenyl]-4,5-dihydro-1H-pyridazin-6-one
Also Known As: Nsp 804, SID:134224514, 4,5-Dihydro-6-(4-((2-methyl-3-oxo-1-cyclopentenyl)amino)phenyl)-3(2H)-pyridazinone, 3(2H)-Pyridazinone, 4,5-dihydro-6-(4-((2-methyl-3-oxo-1-cyclopenten-1-yl)amino)phenyl)-, 3-[4-[(2-methyl-3-oxocyclopenten-1-yl)amino]phenyl]-4,5-dihydro-1H-pyridazin-6-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H17N3O2 |
| Molecular Weight | 283.13208 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 70.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.13208 Da |
| Heavy Atoms | 21 |
| Complexity | 514.0 |
| SMILES | CC1=C(CCC1=O)NC2=CC=C(C=C2)C3=NNC(=O)CC3 |
| InChIKey | IPSXUKGVYYVUEM-UHFFFAOYSA-N |
Chemical Property Profile of Nsp 804
Property Insights of Nsp 804
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nsp 804. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Nsp 804. Following Lipinski's Rule of Five, Nsp 804 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Nsp 804?
The CAS number of Nsp 804 is 125068-43-1.
What is the molecular formula of Nsp 804?
The molecular formula of Nsp 804 is C16H17N3O2.
What is the molecular weight of Nsp 804?
The molecular weight of Nsp 804 is 283.13208 g/mol.
Where can I buy Nsp 804?
You can request a quote for Nsp 804 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nsp 804?
Yes, CoreyChem provides custom synthesis services for Nsp 804 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.