6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-1,3-benzothiazol-2(3H)-one
6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F952-1326 |
| Compound Name: | 6-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C21 H27 N3 O7 S2 |
| Smiles: | C(CN1C(=O)Sc2cc(ccc12)S(N1CCC2(CC1)OCCO2)(=O)=O)C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2398 |
| logD: | 1.2398 |
| logSw: | -2.3812 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 86.239 |
| InChI Key: | YCOAKORLSZIXLM-UHFFFAOYSA-N |