6-[4-(2,1,3-benzothiadiazole-4-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(2,1,3-benzothiadiazole-4-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one
6-[4-(2,1,3-benzothiadiazole-4-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F976-0326 |
| Compound Name: | 6-[4-(2,1,3-benzothiadiazole-4-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C21 H20 N6 O3 S2 |
| Smiles: | C1CN(CCN(C1)S(c1cccc2c1nsn2)(=O)=O)C1C=CC(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5697 |
| logD: | 2.5697 |
| logSw: | -2.7247 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.507 |
| InChI Key: | QSJYXSYKJOPTGP-UHFFFAOYSA-N |