1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}ethan-1-one
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | L898-0328 |
| Compound Name: | 1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C19 H21 N3 O3 S2 |
| Smiles: | C1CN(CCC12OCCO2)C(CSc1c(nccn1)Sc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3008 |
| logD: | 2.3008 |
| logSw: | -2.4075 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.883 |
| InChI Key: | PQMCKKHZJQNEKW-UHFFFAOYSA-N |