7-chloro-1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(4-nitrophenyl)quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-chloro-1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(4-nitrophenyl)quinazoline-2,4(1H,3H)-dione
7-chloro-1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(4-nitrophenyl)quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | V004-1267 |
| Compound Name: | 7-chloro-1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-(4-nitrophenyl)quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 471.9 |
| Molecular Formula: | C22 H22 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(CN1C(N(C(c2ccc(cc12)[Cl])=O)c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8512 |
| logD: | 1.6751 |
| logSw: | -3.1062 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.966 |
| InChI Key: | HEJJWAADABWQHB-UHFFFAOYSA-N |