N-[2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-[2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-[2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-0039 |
| Compound Name: | N-[2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 404.48 |
| Molecular Formula: | C20 H24 N2 O5 S |
| Smiles: | CC1=C(C(Nc2ccccc2C(N2CCC3(CC2)OCCO3)=O)=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 0.9844 |
| logD: | 0.1761 |
| logSw: | -2.531 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.988 |
| InChI Key: | YEFBWCZEFIETNO-UHFFFAOYSA-N |