4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
TL;DR: 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one (CAS 861138-93-4) is a chemical compound with molecular formula C26H31N7O2 and molecular weight 473.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2,2-dimethyl-4-[1-(2-methylphenyl)tetrazol-5-yl]oxan-4-yl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one, 4-({2,2-dimethyl-4-[1-(2-methylphenyl)-1H-tetrazol-5-yl]tetrahydro-2H-pyran-4-yl}amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one, 4-[[2,2-dimethyl-4-[1-(2-methylphenyl)tetrazol-5-yl]oxan-4-yl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one
| Molecular Formula | C26H31N7O2 |
|---|---|
| Molecular Weight | 473.25 g/mol |
| LogP | 3.66494 |
| Topological Polar Surface Area | 91.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.25394 |
| Heavy Atoms | 35 |
| Complexity | 1417.2306 |
Chemical Identifiers
| CAS Number | 861138-93-4 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=NN=N2)C3(CCOC(C3)(C)C)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C |
Product Overview
4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one (CAS 861138-93-4), with molecular formula C26H31N7O2 and molecular weight 473.25 g/mol. IUPAC: 4-[[2,2-dimethyl-4-[1-(2-methylphenyl)tetrazol-5-yl]oxan-4-yl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
Property Insights of 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
The XLogP value of 3.66494 indicates that 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one. Following Lipinski's Rule of Five, 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one has 1 hydrogen bond donor(s) and 6 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-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
The CAS number of 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is 861138-93-4.
What is the molecular formula of 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular formula of 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is C26H31N7O2.
What is the molecular weight of 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular weight of 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is 473.25 g/mol.
Where can I buy 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
You can request a quote for 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-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 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-((2,2-dimethyl-4-(1-(o-tolyl)-1H-tetrazol-5-yl)tetrahydro-2H-pyran-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.