1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butan-1-one
Chemical Structure Depiction of
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butan-1-one
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butan-1-one
Compound characteristics
| Compound ID: | C069-0593 |
| Compound Name: | 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butan-1-one |
| Molecular Weight: | 416.63 |
| Molecular Formula: | C23 H36 N4 O S |
| Smiles: | CC1CC(C)(C)NC(N1CCCC(N1CCN(CC1)c1cc(C)ccc1C)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5879 |
| logD: | 3.5878 |
| logSw: | -3.9008 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.327 |
| InChI Key: | YYNWZYLVLFNKLP-IBGZPJMESA-N |