2-(adamantan-1-yl)-4-chloro-5-(2-methylanilino)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-(2-methylanilino)pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-(2-methylanilino)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C719-0089 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-(2-methylanilino)pyridazin-3(2H)-one |
| Molecular Weight: | 369.89 |
| Molecular Formula: | C21 H24 Cl N3 O |
| Smiles: | Cc1ccccc1NC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 4.8935 |
| logD: | 4.8934 |
| logSw: | -4.8131 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.798 |
| InChI Key: | OWDFFKXVYRPIAW-UHFFFAOYSA-N |