6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-oxo-3-(piperidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-oxo-3-(piperidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one
6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-oxo-3-(piperidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F952-0540 |
| Compound Name: | 6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-oxo-3-(piperidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 495.62 |
| Molecular Formula: | C22 H29 N3 O6 S2 |
| Smiles: | C1CCN(CC1)C(CCN1C(=O)Sc2cc(ccc12)S(N1CCC2(CC1)OCCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3985 |
| logD: | 2.3985 |
| logSw: | -2.7802 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 78.33 |
| InChI Key: | ADGMMBIKBYSEHF-UHFFFAOYSA-N |