BIAdb NSC628305 2833

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BIAdb NSC628305 2833
Systematic (IUPAC) name
1-[(4-aminophenyl)methyl]-2-(benzoyl)isoquinoline-1-carbonitrile
Identifiers
CAS number	?
ATC code	?
PubChem	363401
Chemical data
Formula	C24H19N3O
Mol. mass	365.42716
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

[edit] Description

[edit] Source

N/A

[edit] Function

Unknown

[edit] General Properties

*Molecular Weight

365.42716

*Exact Mass

365.152812

*Molecular Formula

C₂₄H₁₉N₃O

*IUPAC NAME

1-[(4-aminophenyl)methyl]-2-(benzoyl)isoquinoline-1-carbonitrile

*Canonical Smiles

C1=CC=C(C=C1)C(=O)N2C=CC3=CC=CC=C3C2(CC4=CC=C(C=C4)N)C#N

*Isomeric Smiles

N/A

*XLogP

4.1

*Hydrogen bond donor

1

*Hydrogen bond acceptor

3

*Rotational Bond Count

3

*Topological Polar Surface Area

70.1

[edit] External Links

• Pubchem

Link to BIAdb Database