1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine
TL;DR: 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine (CAS 333341-97-2) is a chemical compound with molecular formula C12H14N4O and molecular weight 230.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine
Also Known As: BAS 00387163, N-(2-isopropoxybenzylidene)-N-(4H-1,2,4-triazol-4-yl)amine, 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine
| Molecular Formula | C12H14N4O |
|---|---|
| Molecular Weight | 230.12 g/mol |
| LogP | 1.9475 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.11676 |
| Heavy Atoms | 17 |
| Complexity | 490.96655 |
Chemical Identifiers
| CAS Number | 333341-97-2 |
|---|---|
| SMILES | CC(C)OC1=CC=CC=C1C=NN2C=NN=C2 |
Product Overview
1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine (CAS 333341-97-2), with molecular formula C12H14N4O and molecular weight 230.12 g/mol. IUPAC: 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine.
Chemical Property Profile of 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine
Property Insights of 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine
The XLogP value of 1.9475 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine. With a topological polar surface area (TPSA) of 52.3 Ų, 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine has 0 hydrogen bond donor(s) and 4 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-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine?
The CAS number of 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine is 333341-97-2.
What is the molecular formula of 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine?
The molecular formula of 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine is C12H14N4O.
What is the molecular weight of 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine?
The molecular weight of 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine is 230.12 g/mol.
Where can I buy 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine?
You can request a quote for 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.