![8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole structure](/static/products/848/848869-71-6.png)
8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole
TL;DR: 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole (CAS 848869-71-6) is a chemical compound with molecular formula C13H12ClN3O and molecular weight 261.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole
Also Known As: 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole
| Molecular Formula | C13H12ClN3O |
|---|---|
| Molecular Weight | 261.07 g/mol |
| LogP | 3.5533 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.0669 |
| Heavy Atoms | 18 |
| Complexity | 707.8404 |
Chemical Identifiers
| CAS Number | 848869-71-6 |
|---|---|
| SMILES | CCCOC1=NC=NC2=C1NC3=C2C=C(C=C3)Cl |
Product Overview
8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole (CAS 848869-71-6), with molecular formula C13H12ClN3O and molecular weight 261.07 g/mol. IUPAC: 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole.
Chemical Property Profile of 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole
Property Insights of 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole
The XLogP value of 3.5533 indicates that 8-chloro-4-propoxy-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 50.8 Ų, 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-chloro-4-propoxy-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-chloro-4-propoxy-5H-pyrimido[5,4-b]indole?
The CAS number of 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole is 848869-71-6.
What is the molecular formula of 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole?
The molecular formula of 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole is C13H12ClN3O.
What is the molecular weight of 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole?
The molecular weight of 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole is 261.07 g/mol.
Where can I buy 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole?
You can request a quote for 8-chloro-4-propoxy-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-chloro-4-propoxy-5H-pyrimido[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 8-chloro-4-propoxy-5H-pyrimido[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.