NSC628305

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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1545 Link to BIAdb Database]
[http://crdd.osdd.net/raghava/biadb/detail.php?id=1545 Link to BIAdb Database]
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[[Category:BIAdb_old]]

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Show 2-D Structure

NSC628305
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  ?

[edit] Description

[edit] General Properties

*Molecular Weight

365.42716

*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

3.9

*Topological Polar Surface Area

70.1

[edit] External Links

Link to BIAdb Database