1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one
1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C069-0366 |
| Compound Name: | 1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one |
| Molecular Weight: | 402.56 |
| Molecular Formula: | C21 H30 N4 O2 S |
| Smiles: | CC1CC(C)(C)NC(N1CC(N1CCN(CC1)c1ccc(cc1)C(C)=O)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0044 |
| logD: | 2.0044 |
| logSw: | -2.6064 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.477 |
| InChI Key: | QAORZJDATSDWEA-HNNXBMFYSA-N |