2,9-双(4-硝基苯基)-9H-嘌呤-6-胺
TL;DR: 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 (CAS 136112-70-4) is a chemical compound with molecular formula C17H11N7O4 and molecular weight 377.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,9-双(4-硝基苯基)-9H-嘌呤-6-胺
2,9-bis(4-nitrophenyl)purin-6-amine
Also Known As: 2,9-Bis(p-nitrophenyl)adenine, 2,N(sup 9)-Bis(p-nitrophenyl)adenine, 9H-Purin-6-amine, 2,9-bis(4-nitrophenyl)-, 2,9-Bis(4-nitrophenyl)-9H-purin-6-amine, 2,9-bis(4-nitrophenyl)purin-6-amine
| Molecular Formula | C17H11N7O4 |
|---|---|
| Molecular Weight | 377.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.08725 |
| Heavy Atoms | 28 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 136112-70-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC(=C3C(=N2)N(C=N3)C4=CC=C(C=C4)[N+](=O)[O-])N)[N+](=O)[O-] |
| InChIKey | PFQXBOJKUUTXPL-UHFFFAOYSA-N |
Product Overview
2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 (CAS 136112-70-4), with molecular formula C17H11N7O4 and molecular weight 377.09 g/mol. IUPAC: 2,9-bis(4-nitrophenyl)purin-6-amine.
Chemical Property Profile of 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺
Property Insights of 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺. The TPSA of 161.0 Ų indicates high polarity, suggesting 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 has 1 hydrogen bond donor(s) and 8 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 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺?
The CAS number of 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 is 136112-70-4.
What is the molecular formula of 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺?
The molecular formula of 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 is C17H11N7O4.
What is the molecular weight of 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺?
The molecular weight of 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 is 377.09 g/mol.
Where can I buy 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺?
You can request a quote for 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺?
Yes, KEHONG BIO provides custom synthesis services for 2,9-双(4-硝基苯基)-9H-嘌呤-6-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.