2-phenyl-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
Chemical Structure Depiction of
2-phenyl-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
2-phenyl-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F976-0301 |
| Compound Name: | 2-phenyl-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C24 H28 N4 O3 S |
| Smiles: | Cc1cc(C)c(c(C)c1)S(N1CCCN(CC1)C1C=CC(N(c2ccccc2)N=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9241 |
| logD: | 3.9241 |
| logSw: | -3.9372 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.555 |
| InChI Key: | FXEWCWCVRDYPJG-UHFFFAOYSA-N |