3-(2,1,3-benzothiadiazole-4-sulfonyl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propan-1-one
Chemical Structure Depiction of
3-(2,1,3-benzothiadiazole-4-sulfonyl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propan-1-one
3-(2,1,3-benzothiadiazole-4-sulfonyl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propan-1-one
Compound characteristics
| Compound ID: | C105-0856 |
| Compound Name: | 3-(2,1,3-benzothiadiazole-4-sulfonyl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propan-1-one |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C16 H19 N3 O5 S2 |
| Smiles: | C(CS(c1cccc2c1nsn2)(=O)=O)C(N1CCC2(CC1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7069 |
| logD: | 0.7069 |
| logSw: | -1.9121 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.785 |
| InChI Key: | OPJNCAMAFJVARJ-UHFFFAOYSA-N |