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8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole structure
Fine Chemical

8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole

TL;DR: 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole (CAS 1214629-38-5) is a chemical compound with molecular formula C21H26N4 and molecular weight 334.21576 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)-5H-pyrimido[5,4-b]indole

Also Known As: 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole, 8-methyl-4-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)-5H-pyrimido[5,4-b]indole, 8-methyl-4-((1R,5S)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)-5H-pyrimido[5,4-b]indole

CAS Number
1214629-38-5
Molecular Formula
C21H26N4
Molecular Weight
334.21576 g/mol
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Technical Specifications

Molecular FormulaC21H26N4
Molecular Weight334.21576 g/mol
XLogP5.1
Topological Polar Surface Area (TPSA)44.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds1
Exact Mass334.21576 Da
Heavy Atoms25
Complexity534.0
SMILESCC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CC5(CC4CC(C5)(C)C)C
InChIKeyAQZQOIMXUHPLBV-UHFFFAOYSA-N

Chemical Property Profile of 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole

XLogP
5.1
TPSA (Topological Polar Surface Area)
44.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
1
Heavy Atoms
25
Complexity
534.0
Exact Mass
334.21576
Monoisotopic Mass
334.21576
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 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole

The XLogP value of 5.1 indicates that 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-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 44.8 Ų, 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole?

The CAS number of 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole is 1214629-38-5.

What is the molecular formula of 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole?

The molecular formula of 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole is C21H26N4.

What is the molecular weight of 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole?

The molecular weight of 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole is 334.21576 g/mol.

Where can I buy 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole?

You can request a quote for 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-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 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole?

Yes, CoreyChem provides custom synthesis services for 8-methyl-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-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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