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7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole structure
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7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole

TL;DR: 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole (CAS 121218-49-3) is a chemical compound with molecular formula C17H20N4O2 and molecular weight 312.15863 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

7,8-dimethoxy-4-piperidin-1-yl-5H-pyrimido[5,4-b]indole

Also Known As: 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole, 7,8-Dimethoxy-4-(1-piperidinyl)-5H-pyrimido[5,4-b]indole, 7,8-dimethoxy-4-piperidin-1-yl-5H-pyrimido[5,4-b]indole

CAS Number
121218-49-3
Molecular Formula
C17H20N4O2
Molecular Weight
312.15863 g/mol
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Technical Specifications

Molecular FormulaC17H20N4O2
Molecular Weight312.15863 g/mol
XLogP3.0
Topological Polar Surface Area (TPSA)63.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds3
Exact Mass312.15863 Da
Heavy Atoms23
Complexity404.0
SMILESCOC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)N4CCCCC4)OC
InChIKeyJEBGGGJLNDSORP-UHFFFAOYSA-N

Chemical Property Profile of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole

XLogP
3.0
TPSA (Topological Polar Surface Area)
63.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
3
Heavy Atoms
23
Complexity
404.0
Exact Mass
312.15863
Monoisotopic Mass
312.15863
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole

The XLogP value of 3.0 indicates that 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole. Following Lipinski's Rule of Five, 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole?

The CAS number of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole is 121218-49-3.

What is the molecular formula of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole?

The molecular formula of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole is C17H20N4O2.

What is the molecular weight of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole?

The molecular weight of 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole is 312.15863 g/mol.

Where can I buy 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole?

You can request a quote for 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole?

Yes, CoreyChem provides custom synthesis services for 7,8-dimethoxy-4-(piperidin-1-yl)-5H-pyrimido[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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