SpectraBase Compound ID | DjRCMuckoiO |
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InChI | InChI=1S/C25H29ClFN5O3/c26-18-8-9-19-21(17-18)29-25(35)32(24(19)34)12-3-7-23(33)28-10-4-11-30-13-15-31(16-14-30)22-6-2-1-5-20(22)27/h1-2,5-6,8-9,17H,3-4,7,10-16H2,(H,28,33)(H,29,35) |
InChIKey | GCOPMDQOPQXPQX-UHFFFAOYSA-N |
Mol Weight | 501.99 g/mol |
Molecular Formula | C25H29ClFN5O3 |
Exact Mass | 501.194296 g/mol |
SpectraBase Spectrum ID | 8oM18Cv7Jhj |
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Name | 4-(7-chloro-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-{3-[4-(2-fluorophenyl)-1-piperazinyl]propyl}butanamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 501.194295674 u |
Formula | C25H29ClFN5O3 |
InChI | InChI=1S/C25H29ClFN5O3/c26-18-8-9-19-21(17-18)29-25(35)32(24(19)34)12-3-7-23(33)28-10-4-11-30-13-15-31(16-14-30)22-6-2-1-5-20(22)27/h1-2,5-6,8-9,17H,3-4,7,10-16H2,(H,28,33)(H,29,35) |
InChIKey | GCOPMDQOPQXPQX-UHFFFAOYSA-N |
Molecular Weight | 501.990 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_6443 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12328621 |