2-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-oxo-1-(thiophen-2-yl)propyl]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-oxo-1-(thiophen-2-yl)propyl]-2,3-dihydro-1H-isoindol-1-one
2-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-oxo-1-(thiophen-2-yl)propyl]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
Compound ID: | E787-0364 |
Compound Name: | 2-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-oxo-1-(thiophen-2-yl)propyl]-2,3-dihydro-1H-isoindol-1-one |
Molecular Weight: | 412.51 |
Molecular Formula: | C22 H24 N2 O4 S |
Smiles: | C(C(c1cccs1)N1Cc2ccccc2C1=O)C(N1CCC2(CC1)OCCO2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0212 |
logD: | 2.0212 |
logSw: | -2.7574 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 47.552 |
InChI Key: | HOPAZDFCNCRJFC-SFHVURJKSA-N |