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4-(4-Benzhydryl-1-piperazinyl)-2-(3,4-dichlorophenyl)quinazoline

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4-(4-Benzhydryl-1-piperazinyl)-2-(3,4-dichlorophenyl)quinazoline
SpectraBase Compound ID 8zsnpQh1Lbx
InChI InChI=1S/C31H26Cl2N4/c32-26-16-15-24(21-27(26)33)30-34-28-14-8-7-13-25(28)31(35-30)37-19-17-36(18-20-37)29(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-16,21,29H,17-20H2
InChIKey KAPBAIOGQFEPHT-UHFFFAOYSA-N
Mol Weight 525.48 g/mol
Molecular Formula C31H26Cl2N4
Exact Mass 524.153452 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 73F7mq8Kru
Name 4-(4-Benzhydryl-1-piperazinyl)-2-(3,4-dichlorophenyl)quinazoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 524.153452253 u
Formula C31H26Cl2N4
InChI InChI=1S/C31H26Cl2N4/c32-26-16-15-24(21-27(26)33)30-34-28-14-8-7-13-25(28)31(35-30)37-19-17-36(18-20-37)29(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-16,21,29H,17-20H2
InChIKey KAPBAIOGQFEPHT-UHFFFAOYSA-N
Molecular Weight 525.483 g/mol
SMILES C=1C=CC(C(N2CCN(C3=NC(=NC4=CC=CC=C34)C=3C=C(Cl)C(=CC3)Cl)CC2)C=2C=CC=CC2)=CC1