2-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one
Chemical Structure Depiction of
2-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one
2-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one
Compound characteristics
| Compound ID: | Y041-0384 |
| Compound Name: | 2-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,6,7,8-tetrahydrocinnolin-3(2H)-one |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C22 H28 N4 O2 |
| Smiles: | Cc1ccc(c(C)c1)N1CCN(CC1)C(CN1C(C=C2CCCCC2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0544 |
| logD: | 3.0539 |
| logSw: | -3.1855 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.585 |
| InChI Key: | SEQDOFBNQZNHKV-UHFFFAOYSA-N |