3-{4-[4-(4-acetylphenyl)piperazin-1-yl]-4-oxobutyl}-6-bromoquinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-{4-[4-(4-acetylphenyl)piperazin-1-yl]-4-oxobutyl}-6-bromoquinazoline-2,4(1H,3H)-dione
3-{4-[4-(4-acetylphenyl)piperazin-1-yl]-4-oxobutyl}-6-bromoquinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C190-0426 |
| Compound Name: | 3-{4-[4-(4-acetylphenyl)piperazin-1-yl]-4-oxobutyl}-6-bromoquinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 513.39 |
| Molecular Formula: | C24 H25 Br N4 O4 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(CCCN1C(c2cc(ccc2NC1=O)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8265 |
| logD: | 2.7779 |
| logSw: | -3.4392 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.938 |
| InChI Key: | MDDIGFZNDXLGTC-UHFFFAOYSA-N |