N-{3-[5-chloro-4-(4-chloroanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
Chemical Structure Depiction of
N-{3-[5-chloro-4-(4-chloroanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
N-{3-[5-chloro-4-(4-chloroanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
Compound characteristics
| Compound ID: | C301-2861 |
| Compound Name: | N-{3-[5-chloro-4-(4-chloroanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide |
| Molecular Weight: | 447.36 |
| Molecular Formula: | C22 H24 Cl2 N4 O2 |
| Smiles: | CC(NC12CC3CC(C1)CC(C3)(C2)N1C(C(=C(C=N1)Nc1ccc(cc1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1281 |
| logD: | 4.128 |
| logSw: | -4.4062 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.742 |
| InChI Key: | RGGMUFOJJDAEDE-UHFFFAOYSA-N |