![1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one structure](/static/products/799/799809-27-1.png)
1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one
TL;DR: 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one (CAS 799809-27-1) is a chemical compound with molecular formula C23H25N7O4 and molecular weight 463.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethyl-4-[[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-2-phenylpyrazol-3-one
Also Known As: 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one, 1,5-dimethyl-4-[[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-2-phenylpyrazol-3-one, 1,5-Dimethyl-4-[7-(3-methyl-piperidin-1-yl)-4-nitro-benzo[1,2,5]oxadiazol-5-ylamino]-2-phenyl-1,2-dihyd ro-pyrazol-3-one, 1,5-dimethyl-4-{[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C23H25N7O4 |
|---|---|
| Molecular Weight | 463.20 g/mol |
| LogP | 3.90872 |
| Topological Polar Surface Area | 124.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 463.1968 |
| Heavy Atoms | 34 |
| Complexity | 1437.2922 |
Chemical Identifiers
| CAS Number | 799809-27-1 |
|---|---|
| SMILES | CC1CCCN(C1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C |
Product Overview
1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one (CAS 799809-27-1), with molecular formula C23H25N7O4 and molecular weight 463.20 g/mol. IUPAC: 1,5-dimethyl-4-[[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-2-phenylpyrazol-3-one.
Chemical Property Profile of 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one
Property Insights of 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one
The XLogP value of 3.90872 indicates that 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one. Following Lipinski's Rule of Five, 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one has 1 hydrogen bond donor(s) and 8 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 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one?
The CAS number of 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one is 799809-27-1.
What is the molecular formula of 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular formula of 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one is C23H25N7O4.
What is the molecular weight of 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular weight of 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one is 463.20 g/mol.
Where can I buy 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one?
You can request a quote for 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1,5-dimethyl-4-((7-(3-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)-2-phenyl-1H-pyrazol-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.