4-{4-[(1,2-benzoxazol-3-yl)methyl]piperazine-1-sulfonyl}-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-{4-[(1,2-benzoxazol-3-yl)methyl]piperazine-1-sulfonyl}-2,1,3-benzothiadiazole
4-{4-[(1,2-benzoxazol-3-yl)methyl]piperazine-1-sulfonyl}-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | L269-0929 |
| Compound Name: | 4-{4-[(1,2-benzoxazol-3-yl)methyl]piperazine-1-sulfonyl}-2,1,3-benzothiadiazole |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C18 H17 N5 O3 S2 |
| Smiles: | C1CN(CCN1Cc1c2ccccc2on1)S(c1cccc2c1nsn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.694 |
| logD: | 2.6934 |
| logSw: | -2.9677 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.137 |
| InChI Key: | ISUSXGWSLDDWOU-UHFFFAOYSA-N |