Wz3146

C₂₄H₂₅ClN₆O₂CAS 1214265-56-1464.95 g/mol

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Alkene Amide Aryl halide Ether Secondary amine Tertiary amine

Properties

Molecular formula: C₂₄H₂₅ClN₆O₂
Molar mass: 464.95 g/mol
Exact mass: 464.1728 Da
logP: 4.54Crippen estimate
Polar surface area: 82.6 Å²
H-bond donors / acceptors: 2 / 7
Rotatable bonds: 7

Hazards

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

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Identifiers

CAS number

1214265-56-1

SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=N3)OC4=CC=CC(=C4)NC(=O)C=C)Cl

InChIKey

APHGZZPEOCCYNO-UHFFFAOYSA-N

InChI

InChI=1S/C24H25ClN6O2/c1-3-22(32)27-18-5-4-6-20(15-18)33-23-21(25)16-26-24(29-23)28-17-7-9-19(10-8-17)31-13-11-30(2)12-14-31/h3-10,15-16H,1,11-14H2,2H3,(H,27,32)(H,26,28,29)

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Tanimoto similarity of circular fingerprints over the whole catalogue.

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Elsewhere

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