1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(3-nitrophenyl)quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(3-nitrophenyl)quinazoline-2,4(1H,3H)-dione
1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(3-nitrophenyl)quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | V004-1231 |
| Compound Name: | 1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(3-nitrophenyl)quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 437.45 |
| Molecular Formula: | C22 H23 N5 O5 |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(CN1C(N(C(c2ccccc12)=O)c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8685 |
| logD: | 0.6923 |
| logSw: | -2.4494 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.966 |
| InChI Key: | OQAMHEGKVNYRPT-UHFFFAOYSA-N |