![6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine structure](/static/products/5233/52333-18-3.webp)
6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine
TL;DR: 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine (CAS 52333-18-3) is a chemical compound with molecular formula C7H12N4 and molecular weight 152.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine
Also Known As: 1,8,9-triazabicyclo[5.3.0]deca-7,9-dien-10-amine, 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine
| Molecular Formula | C7H12N4 |
|---|---|
| Molecular Weight | 152.11 g/mol |
| LogP | 0.5867 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 152.1062 |
| Heavy Atoms | 11 |
| Complexity | 252.9433 |
Chemical Identifiers
| CAS Number | 52333-18-3 |
|---|---|
| SMILES | C1CCC2=NN=C(N2CC1)N |
Product Overview
6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine (CAS 52333-18-3), with molecular formula C7H12N4 and molecular weight 152.11 g/mol. IUPAC: 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine.
Chemical Property Profile of 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine
Property Insights of 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine
The XLogP value of 0.5867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine. With a topological polar surface area (TPSA) of 56.73 Ų, 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-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 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine?
The CAS number of 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine is 52333-18-3.
What is the molecular formula of 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine?
The molecular formula of 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine is C7H12N4.
What is the molecular weight of 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine?
The molecular weight of 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine is 152.11 g/mol.
Where can I buy 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine?
You can request a quote for 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.