3-{3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl}-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one
Chemical Structure Depiction of
3-{3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl}-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one
3-{3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl}-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one
Compound characteristics
| Compound ID: | K279-0385 |
| Compound Name: | 3-{3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl}-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one |
| Molecular Weight: | 478.53 |
| Molecular Formula: | C23 H22 N6 O4 S |
| Smiles: | C(CC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)C1C(N=C2c3ccccc3NC(N12)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3106 |
| logD: | 1.8367 |
| logSw: | -2.9948 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.279 |
| InChI Key: | FICMTSNJFLMXEZ-LJQANCHMSA-N |