6-[4-(2-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(2-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one
6-[4-(2-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F976-0324 |
| Compound Name: | 6-[4-(2-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3(2H)-one |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | Cc1ccccc1S(N1CCCN(CC1)C1C=CC(N(c2ccccc2)N=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7769 |
| logD: | 2.7769 |
| logSw: | -3.1095 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.555 |
| InChI Key: | WZMWWDCWFRTRPQ-UHFFFAOYSA-N |