![N-cyclopentyl-4-[(1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide](/api/spectrum/2B7mHokJHm8/structure.png?h=300&w=458 "N-cyclopentyl-4-[(1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide")
| SpectraBase Compound ID | 5nxEieAFEso |
|---|---|
| InChI | InChI=1S/C33H42N4O6/c1-42-28-16-13-22(19-29(28)43-2)17-18-34-30(38)21-36-27-10-6-5-9-26(27)32(40)37(33(36)41)20-23-11-14-24(15-12-23)31(39)35-25-7-3-4-8-25/h5-6,9-10,13,16,19,23-25H,3-4,7-8,11-12,14-15,17-18,20-21H2,1-2H3,(H,34,38)(H,35,39) |
| InChIKey | DVRIWCHRZHIFPP-UHFFFAOYSA-N |
| Mol Weight | 590.7 g/mol |
| Molecular Formula | C33H42N4O6 |
| Exact Mass | 590.310435 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 2B7mHokJHm8 |
|---|---|
| Name | N-cyclopentyl-4-[(1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 590.310435082 u |
| Formula | C33H42N4O6 |
| InChI | InChI=1S/C33H42N4O6/c1-42-28-16-13-22(19-29(28)43-2)17-18-34-30(38)21-36-27-10-6-5-9-26(27)32(40)37(33(36)41)20-23-11-14-24(15-12-23)31(39)35-25-7-3-4-8-25/h5-6,9-10,13,16,19,23-25H,3-4,7-8,11-12,14-15,17-18,20-21H2,1-2H3,(H,34,38)(H,35,39) |
| InChIKey | DVRIWCHRZHIFPP-UHFFFAOYSA-N |
| Molecular Weight | 590.721 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_8144 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13219144 |