3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methylazepan-2-one
Chemical Structure Depiction of
3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methylazepan-2-one
3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methylazepan-2-one
Compound characteristics
| Compound ID: | S581-0400 |
| Compound Name: | 3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methylazepan-2-one |
| Molecular Weight: | 357.5 |
| Molecular Formula: | C21 H31 N3 O2 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(CC1CCCCN(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6169 |
| logD: | 2.6169 |
| logSw: | -2.6136 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.255 |
| InChI Key: | ULUUWWZCDDRCOQ-GOSISDBHSA-N |