| SpectraBase Spectrum ID |
2K8CKfkpnr4 |
| Name |
3-{3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl}-2,4(1H,3H)-quinazolinedione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.150953695 u |
| Formula |
C21H23ClN4O2 |
| InChI |
InChI=1S/C21H23ClN4O2/c22-16-5-3-6-17(15-16)25-13-11-24(12-14-25)9-4-10-26-20(27)18-7-1-2-8-19(18)23-21(26)28/h1-3,5-8,15H,4,9-14H2,(H,23,28) |
| InChIKey |
FXZJKVODWNYPKK-UHFFFAOYSA-N |
| Molecular Weight |
398.894 g/mol |
| SMILES |
C1(NC2=C(C(N1CCCN1CCN(CC1)C1=CC(=CC=C1)Cl)=O)C=CC=C2)=O |
![3-{3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl}-2,4(1H,3H)-quinazolinedione](/api/spectrum/2K8CKfkpnr4/structure.png?h=300&w=458 "3-{3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl}-2,4(1H,3H)-quinazolinedione")
