(4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine
TL;DR: (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine (CAS 356076-10-3) is a chemical compound with molecular formula C12H16N4 and molecular weight 216.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-4-amine
Also Known As: BAS 07019070, (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine, N-[4-(propan-2-yl)benzyl]-4H-1,2,4-triazol-4-amine, {[4-(methylethyl)phenyl]methyl}-1,2,4-triazol-4-ylamine, N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-4-amine
| Molecular Formula | C12H16N4 |
|---|---|
| Molecular Weight | 216.14 g/mol |
| LogP | 2.1452 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 216.1375 |
| Heavy Atoms | 16 |
| Complexity | 416.7892 |
Chemical Identifiers
| CAS Number | 356076-10-3 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)CNN2C=NN=C2 |
Product Overview
(4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine (CAS 356076-10-3), with molecular formula C12H16N4 and molecular weight 216.14 g/mol. IUPAC: N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-4-amine.
Chemical Property Profile of (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine
Property Insights of (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine
The XLogP value of 2.1452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine. With a topological polar surface area (TPSA) of 42.74 Ų, (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine has 1 hydrogen bond donor(s) and 3 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-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine?
The CAS number of (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine is 356076-10-3.
What is the molecular formula of (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine?
The molecular formula of (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine is C12H16N4.
What is the molecular weight of (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine?
The molecular weight of (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine is 216.14 g/mol.
Where can I buy (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine?
You can request a quote for (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine?
Yes, KEHONG BIO provides custom synthesis services for (4-Isopropyl-benzyl)-[1,2,4]triazol-4-yl-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.