1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one
TL;DR: 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one (CAS 879766-45-7) is a chemical compound with molecular formula C23H22N4O3 and molecular weight 402.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(furan-2-yl)-5-[(4-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-3-phenylpropan-1-one
Also Known As: 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one, 1-[3-(furan-2-yl)-5-[(4-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-3-phenylpropan-1-one, 1-[3-(FURAN-2-YL)-5-{[(4-METHOXYPHENYL)METHYL]AMINO}-1H-1,2,4-TRIAZOL-1-YL]-3-PHENYLPROPAN-1-ONE, 1-{3-(furan-2-yl)-5-[(4-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-phenylpropan-1-one
| Molecular Formula | C23H22N4O3 |
|---|---|
| Molecular Weight | 402.17 g/mol |
| LogP | 4.4318 |
| Topological Polar Surface Area | 82.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 402.1692 |
| Heavy Atoms | 30 |
| Complexity | 1087.4558 |
Chemical Identifiers
| CAS Number | 879766-45-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)CCC3=CC=CC=C3)C4=CC=CO4 |
Product Overview
1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one (CAS 879766-45-7), with molecular formula C23H22N4O3 and molecular weight 402.17 g/mol. IUPAC: 1-[3-(furan-2-yl)-5-[(4-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-3-phenylpropan-1-one.
Chemical Property Profile of 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one
Property Insights of 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one
The XLogP value of 4.4318 indicates that 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one. Following Lipinski's Rule of Five, 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-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 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one?
The CAS number of 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one is 879766-45-7.
What is the molecular formula of 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one?
The molecular formula of 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one is C23H22N4O3.
What is the molecular weight of 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one?
The molecular weight of 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one is 402.17 g/mol.
Where can I buy 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one?
You can request a quote for 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-(furan-2-yl)-5-((4-methoxybenzyl)amino)-1H-1,2,4-triazol-1-yl)-3-phenylpropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.