1-(2,1,3-benzothiadiazole-4-sulfonyl)tetrahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazin]-1'(2'H)-one
Chemical Structure Depiction of
1-(2,1,3-benzothiadiazole-4-sulfonyl)tetrahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazin]-1'(2'H)-one
1-(2,1,3-benzothiadiazole-4-sulfonyl)tetrahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazin]-1'(2'H)-one
Compound characteristics
Compound ID: | S730-0259 |
Compound Name: | 1-(2,1,3-benzothiadiazole-4-sulfonyl)tetrahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazin]-1'(2'H)-one |
Molecular Weight: | 407.51 |
Molecular Formula: | C17 H21 N5 O3 S2 |
Smiles: | C1CN(CCC12CC1C(NCCN1C2)=O)S(c1cccc2c1nsn2)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 0.8758 |
logD: | -0.0091 |
logSw: | -2.2685 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.361 |
InChI Key: | XQCSYXYNUPPIMA-CYBMUJFWSA-N |