![1H-萘并[1,8-de][1,2,3]三嗪-1-胺 structure](/static/products/2121/21218-92-8.webp)
1H-萘并[1,8-de][1,2,3]三嗪-1-胺
TL;DR: 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 (CAS 21218-92-8) is a chemical compound with molecular formula C10H8N4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-萘并[1,8-de][1,2,3]三嗪-1-胺
2,3,4-triazatricyclo[7.3.1.05,13]trideca-1(12),3,5,7,9(13),10-hexaen-2-amine
Also Known As: 1h-naphtho[1,8-de][1,2,3]triazin-1-amine, 1-Amino-1H-naphtho[1,8-de]-1,2,3-triazine, naphtho[1,8-de][1,2,3]triazin-1-ylamine, 2,3,4-triazatricyclo[7.3.1.05,13]trideca-1(13),3,5,7,9,11-hexaen-2-amine
| Molecular Formula | C10H8N4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.07489 |
| Heavy Atoms | 14 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 21218-92-8 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)N=NN(C3=CC=C2)N |
| InChIKey | GTIKCUOEXAKRNT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-萘并[1,8-de][1,2,3]三嗪-1-胺 (CAS 21218-92-8), with molecular formula C10H8N4 and molecular weight 184.07 g/mol. IUPAC: 2,3,4-triazatricyclo[7.3.1.05,13]trideca-1(12),3,5,7,9(13),10-hexaen-2-amine.
Chemical Property Profile of 1H-萘并[1,8-de][1,2,3]三嗪-1-胺
Property Insights of 1H-萘并[1,8-de][1,2,3]三嗪-1-胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-萘并[1,8-de][1,2,3]三嗪-1-胺. With a topological polar surface area (TPSA) of 54.0 Ų, 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 has 1 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 1H-萘并[1,8-de][1,2,3]三嗪-1-胺?
The CAS number of 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 is 21218-92-8.
What is the molecular formula of 1H-萘并[1,8-de][1,2,3]三嗪-1-胺?
The molecular formula of 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 is C10H8N4.
What is the molecular weight of 1H-萘并[1,8-de][1,2,3]三嗪-1-胺?
The molecular weight of 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 is 184.07 g/mol.
Where can I buy 1H-萘并[1,8-de][1,2,3]三嗪-1-胺?
You can request a quote for 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-萘并[1,8-de][1,2,3]三嗪-1-胺?
Yes, KEHONG BIO provides custom synthesis services for 1H-萘并[1,8-de][1,2,3]三嗪-1-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.