2-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one
Chemical Structure Depiction of
2-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one
2-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one
Compound characteristics
| Compound ID: | J103-0193 |
| Compound Name: | 2-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one |
| Molecular Weight: | 386.88 |
| Molecular Formula: | C20 H23 Cl N4 O2 |
| Smiles: | C1CCC2C(C1)=CC(N(CC(N1CCN(CC1)c1ccc(cc1)[Cl])=O)N=2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4329 |
| logD: | 2.4329 |
| logSw: | -2.9296 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.886 |
| InChI Key: | OSAQYQIBPQYXHU-UHFFFAOYSA-N |