![8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole structure](/static/products/797/797767-06-7.png)
8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole
TL;DR: 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole (CAS 797767-06-7) is a chemical compound with molecular formula C14H13BrN4 and molecular weight 316.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-4-pyrrolidin-1-yl-5H-pyrimido[5,4-b]indole
Also Known As: 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole, 8-bromo-4-pyrrolidin-1-yl-5H-pyrimido[5,4-b]indole
| Molecular Formula | C14H13BrN4 |
|---|---|
| Molecular Weight | 316.03 g/mol |
| LogP | 3.4738 |
| Topological Polar Surface Area | 44.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.03235 |
| Heavy Atoms | 19 |
| Complexity | 758.5671 |
Chemical Identifiers
| CAS Number | 797767-06-7 |
|---|---|
| SMILES | C1CCN(C1)C2=NC=NC3=C2NC4=C3C=C(C=C4)Br |
Product Overview
8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole (CAS 797767-06-7), with molecular formula C14H13BrN4 and molecular weight 316.03 g/mol. IUPAC: 8-bromo-4-pyrrolidin-1-yl-5H-pyrimido[5,4-b]indole.
Chemical Property Profile of 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole
Property Insights of 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole
The XLogP value of 3.4738 indicates that 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.81 Ų, 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole 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 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole?
The CAS number of 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole is 797767-06-7.
What is the molecular formula of 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole?
The molecular formula of 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole is C14H13BrN4.
What is the molecular weight of 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole?
The molecular weight of 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole is 316.03 g/mol.
Where can I buy 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole?
You can request a quote for 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.