2-(adamantan-1-yl)-4-chloro-5-(5-chloro-2,4-dimethoxyanilino)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-(5-chloro-2,4-dimethoxyanilino)pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-(5-chloro-2,4-dimethoxyanilino)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C301-1560 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-(5-chloro-2,4-dimethoxyanilino)pyridazin-3(2H)-one |
| Molecular Weight: | 450.36 |
| Molecular Formula: | C22 H25 Cl2 N3 O3 |
| Smiles: | COc1cc(c(cc1NC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)C2)C1)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.3975 |
| logD: | 5.3944 |
| logSw: | -5.9953 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.059 |
| InChI Key: | FZAQKEZMBHKWFH-UHFFFAOYSA-N |