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9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- structure
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9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-

TL;DR: 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- (CAS 127042-69-7) is a chemical compound with molecular formula C17H13N3 and molecular weight 259.11096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-phenyl-9H-pyrido[3,4-b]indol-6-amine

Also Known As: 1-phenyl-9H-, A-carbolin-6-amine, 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-, 1-phenyl-9H-pyrido[3,4-b]indol-6-amine, NCI60_006001

CAS Number
127042-69-7
Molecular Formula
C17H13N3
Molecular Weight
259.11096 g/mol
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Technical Specifications

Molecular FormulaC17H13N3
Molecular Weight259.11096 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)54.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass259.11096 Da
Heavy Atoms20
Complexity339.0
SMILESC1=CC=C(C=C1)C2=NC=CC3=C2NC4=C3C=C(C=C4)N
InChIKeyJPFQINVOSKUDHH-UHFFFAOYSA-N

Chemical Property Profile of 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-

XLogP
3.3
TPSA (Topological Polar Surface Area)
54.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
20
Complexity
339.0
Exact Mass
259.11096
Monoisotopic Mass
259.11096
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 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-

The XLogP value of 3.3 indicates that 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.7 Ų, 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-?

The CAS number of 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- is 127042-69-7.

What is the molecular formula of 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-?

The molecular formula of 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- is C17H13N3.

What is the molecular weight of 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-?

The molecular weight of 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- is 259.11096 g/mol.

Where can I buy 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-?

You can request a quote for 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl-?

Yes, CoreyChem provides custom synthesis services for 9H-Pyrido[3,4-b]indol-6-amine, 1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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