7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene
TL;DR: 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene (CAS 88061-91-0) is a chemical compound with molecular formula C16H17Br2N7 and molecular weight 464.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,12-dibromo-3,7-dipyrrolidin-1-yl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaene
Also Known As: 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene, 7,9-dibromo-2,5-bis(1-pyrrolidino)-1,3,4,6,9b-pentaazaphenal
| Molecular Formula | C16H17Br2N7 |
|---|---|
| Molecular Weight | 464.99 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 59.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 464.9912 |
| Heavy Atoms | 25 |
| Complexity | 748.0 |
Chemical Identifiers
| CAS Number | 88061-91-0 |
|---|---|
| SMILES | C1CCN(C1)C2=NC3=C(C=C(C4=NC(=NC(=N2)N34)N5CCCC5)Br)Br |
| InChIKey | FYCBMTXPBWVQKR-UHFFFAOYSA-N |
Product Overview
7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene (CAS 88061-91-0), with molecular formula C16H17Br2N7 and molecular weight 464.99 g/mol. IUPAC: 10,12-dibromo-3,7-dipyrrolidin-1-yl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaene.
Chemical Property Profile of 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene
Property Insights of 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene
The XLogP value of 4.5 indicates that 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.2 Ų, 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene has 0 hydrogen bond donor(s) and 1 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 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene?
The CAS number of 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene is 88061-91-0.
What is the molecular formula of 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene?
The molecular formula of 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene is C16H17Br2N7.
What is the molecular weight of 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene?
The molecular weight of 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene is 464.99 g/mol.
Where can I buy 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene?
You can request a quote for 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene?
Yes, KEHONG BIO provides custom synthesis services for 7,9-Dibromo-2,5-di(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.