4-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-sulfonyl)-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-sulfonyl)-2,1,3-benzothiadiazole
4-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-sulfonyl)-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | T501-0556 |
| Compound Name: | 4-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-sulfonyl)-2,1,3-benzothiadiazole |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C18 H22 N6 O2 S2 |
| Smiles: | C1CC(Cc2nncn2CC2CC2)CN(C1)S(c1cccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3116 |
| logD: | 2.3116 |
| logSw: | -2.5632 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.42 |
| InChI Key: | KGDKTXYFTXMVIV-CQSZACIVSA-N |