1-ethyl-3-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-ethyl-3-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}quinazoline-2,4(1H,3H)-dione
1-ethyl-3-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | K852-0175 |
| Compound Name: | 1-ethyl-3-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 437.45 |
| Molecular Formula: | C22 H23 N5 O5 |
| Smiles: | CCN1C(N(CC(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)C(c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0288 |
| logD: | 2.0288 |
| logSw: | -2.7672 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 84.297 |
| InChI Key: | GXEJGGFMXDTLTA-UHFFFAOYSA-N |