7-chloro-3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-chloro-3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione
7-chloro-3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C260-2048 |
| Compound Name: | 7-chloro-3-{4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl}quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 471.9 |
| Molecular Formula: | C22 H22 Cl N5 O5 |
| Smiles: | C(CC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)CN1C(c2ccc(cc2NC1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8651 |
| logD: | 2.807 |
| logSw: | -3.8116 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.493 |
| InChI Key: | WEXPPMYHEBFJND-UHFFFAOYSA-N |