1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one
1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C069-0344 |
| Compound Name: | 1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethan-1-one |
| Molecular Weight: | 388.57 |
| Molecular Formula: | C21 H32 N4 O S |
| Smiles: | CC1CC(C)(C)NC(N1CC(N1CCN(C(C)C1)c1cccc(C)c1)=O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.252 |
| logD: | 3.2517 |
| logSw: | -3.3191 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.868 |
| InChI Key: | ARDQSLOHGWXHHQ-UHFFFAOYSA-N |