N-{3-[4-(benzylamino)-5-chloro-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
Chemical Structure Depiction of
N-{3-[4-(benzylamino)-5-chloro-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
N-{3-[4-(benzylamino)-5-chloro-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
Compound characteristics
| Compound ID: | C301-3148 |
| Compound Name: | N-{3-[4-(benzylamino)-5-chloro-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide |
| Molecular Weight: | 426.95 |
| Molecular Formula: | C23 H27 Cl N4 O2 |
| Smiles: | CC(NC12CC3CC(C1)CC(C3)(C2)N1C(C(=C(C=N1)NCc1ccccc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0637 |
| logD: | 3.0637 |
| logSw: | -3.5096 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.064 |
| InChI Key: | VEHFNSIIBBAEQH-UHFFFAOYSA-N |