2-(adamantan-1-yl)-4-chloro-5-(4-hydroxyanilino)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-(4-hydroxyanilino)pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-(4-hydroxyanilino)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C719-0095 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-(4-hydroxyanilino)pyridazin-3(2H)-one |
| Molecular Weight: | 371.87 |
| Molecular Formula: | C20 H22 Cl N3 O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1C(C(=C(C=N1)Nc1ccc(cc1)O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2195 |
| logD: | 4.2172 |
| logSw: | -4.3016 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.113 |
| InChI Key: | KUQTZSAVKGSCDK-UHFFFAOYSA-N |