1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({3-[(2-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({3-[(2-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)ethan-1-one
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({3-[(2-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | L898-0765 |
| Compound Name: | 1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({3-[(2-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)ethan-1-one |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C20 H23 N3 O3 S2 |
| Smiles: | Cc1ccccc1Sc1c(nccn1)SCC(N1CCC2(CC1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6614 |
| logD: | 2.6614 |
| logSw: | -2.6448 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.883 |
| InChI Key: | YWIUGHXEABTRKQ-UHFFFAOYSA-N |