N-[(2-methyl-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide
Chemical Structure Depiction of
N-[(2-methyl-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide
N-[(2-methyl-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide
Compound characteristics
| Compound ID: | S582-0061 |
| Compound Name: | N-[(2-methyl-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C15 H15 N5 O3 S2 |
| Smiles: | CN1C(CNS(c2cccc3c2nsn3)(=O)=O)Cn2cccc2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2277 |
| logD: | 1.2176 |
| logSw: | -2.3103 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.232 |
| InChI Key: | USFINMKHUNZJOV-JTQLQIEISA-N |