2-(adamantan-1-yl)-4-chloro-5-(2-methoxy-5-methylanilino)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-(2-methoxy-5-methylanilino)pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-(2-methoxy-5-methylanilino)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C719-0027 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-(2-methoxy-5-methylanilino)pyridazin-3(2H)-one |
| Molecular Weight: | 399.92 |
| Molecular Formula: | C22 H26 Cl N3 O2 |
| Smiles: | Cc1ccc(c(c1)NC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)C2)C1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.9355 |
| logD: | 4.9353 |
| logSw: | -4.9536 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.428 |
| InChI Key: | JOUBYWBKUINHQD-UHFFFAOYSA-N |