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C25H19N3O3CAS 1127442-82-3409.45 g/mol

Open in Covalent MOL file
ONOOHNN
AlkeneAmideLactam

Properties

Molecular formula
C25H19N3O3
Molar mass
409.45 g/mol
Exact mass
409.1426 Da
logP
3.80Crippen estimate
Polar surface area
79.4 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
3
Stereocentres
R, S, R, Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
1127442-82-3
SMILES
C1[C@@H]2C=C[C@H]1[C@@H]3[C@H]2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)NC5=CC=CC6=C5N=CC=C6
InChIKey
ZGSXEXBYLJIOGF-ALFLXDJESA-N
InChI
InChI=1S/C25H19N3O3/c29-23(27-19-5-1-3-14-4-2-12-26-22(14)19)15-8-10-18(11-9-15)28-24(30)20-16-6-7-17(13-16)21(20)25(28)31/h1-12,16-17,20-21H,13H2,(H,27,29)/t16-,17+,20-,21+

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Elsewhere

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