4-(1,3-benzothiazol-2-yl)-1-(1-oxa-9-azaspiro[5.5]undecan-9-yl)butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-(1-oxa-9-azaspiro[5.5]undecan-9-yl)butan-1-one
4-(1,3-benzothiazol-2-yl)-1-(1-oxa-9-azaspiro[5.5]undecan-9-yl)butan-1-one
Compound characteristics
| Compound ID: | T500-1510 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-(1-oxa-9-azaspiro[5.5]undecan-9-yl)butan-1-one |
| Molecular Weight: | 358.5 |
| Molecular Formula: | C20 H26 N2 O2 S |
| Smiles: | C(CC(N1CCC2(CCCCO2)CC1)=O)Cc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3858 |
| logD: | 3.3858 |
| logSw: | -3.5866 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.177 |
| InChI Key: | NDVZVWRMWCKRIV-UHFFFAOYSA-N |