CID 3076525
Piperazine, 1-(4-((7-bromo-4-oxo-2-phenyl-3(4h)-quinazolinyl)amino)benzoyl)-4-methyl-
Structural Information
- Molecular Formula
- C26H24BrN5O2
- SMILES
- CN1CCN(CC1)C(=O)C2=CC=C(C=C2)NN3C(=NC4=C(C3=O)C=CC(=C4)Br)C5=CC=CC=C5
- InChI
- InChI=1S/C26H24BrN5O2/c1-30-13-15-31(16-14-30)25(33)19-7-10-21(11-8-19)29-32-24(18-5-3-2-4-6-18)28-23-17-20(27)9-12-22(23)26(32)34/h2-12,17,29H,13-16H2,1H3
- InChIKey
- GBDZVSGGWRLYMD-UHFFFAOYSA-N
- Compound name
- 7-bromo-3-[4-(4-methylpiperazine-1-carbonyl)anilino]-2-phenylquinazolin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 518.11858 | 216.8 |
[M+Na]+ | 540.10052 | 224.4 |
[M-H]- | 516.10402 | 226.1 |
[M+NH4]+ | 535.14512 | 221.2 |
[M+K]+ | 556.07446 | 210.4 |
[M+H-H2O]+ | 500.10856 | 209.8 |
[M+HCOO]- | 562.10950 | 227.5 |
[M+CH3COO]- | 576.12515 | 224.1 |
[M+Na-2H]- | 538.08597 | 219.3 |
[M]+ | 517.11075 | 231.3 |
[M]- | 517.11185 | 231.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.