2-(benzylsulfanyl)-N-{2-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]ethyl}acetamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-N-{2-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]ethyl}acetamide
2-(benzylsulfanyl)-N-{2-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]ethyl}acetamide
Compound characteristics
| Compound ID: | F744-0424 |
| Compound Name: | 2-(benzylsulfanyl)-N-{2-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]ethyl}acetamide |
| Molecular Weight: | 447.62 |
| Molecular Formula: | C22 H29 N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CCNC(CSCc2ccccc2)=O)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7968 |
| logD: | 2.7937 |
| logSw: | -3.2858 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.781 |
| InChI Key: | OZNKKJBQOZSRKE-UHFFFAOYSA-N |