1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)ethan-1-one
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | C523-2406 |
| Compound Name: | 1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)ethan-1-one |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C21 H26 N2 O4 S |
| Smiles: | Cc1ccc(cc1)c1nc(CSCC(N2CCC3(CC2)OCCO3)=O)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.1358 |
| logD: | 3.1358 |
| logSw: | -3.1366 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.918 |
| InChI Key: | DECJFKIKYFFKTF-UHFFFAOYSA-N |