3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione
3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | K221-2762 |
| Compound Name: | 3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 437.45 |
| Molecular Formula: | C22 H23 N5 O5 |
| Smiles: | C(CC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)CN1C(c2ccccc2NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3703 |
| logD: | 2.3695 |
| logSw: | -3.0616 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.493 |
| InChI Key: | JDYLZBZRFKUEAL-UHFFFAOYSA-N |