1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propan-1-one
Chemical Structure Depiction of
1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propan-1-one
1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propan-1-one
Compound characteristics
| Compound ID: | C069-0153 |
| Compound Name: | 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propan-1-one |
| Molecular Weight: | 404.57 |
| Molecular Formula: | C21 H32 N4 O2 S |
| Smiles: | CC1CC(C)(C)NC(N1CCC(N1CCN(CC1)c1ccc(cc1)OC)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6903 |
| logD: | 2.69 |
| logSw: | -3.1328 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.172 |
| InChI Key: | DMVUPBJPKUEZLM-INIZCTEOSA-N |