N-{3-[5-chloro-4-(3-ethylanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
Chemical Structure Depiction of
N-{3-[5-chloro-4-(3-ethylanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
N-{3-[5-chloro-4-(3-ethylanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide
Compound characteristics
| Compound ID: | C301-3326 |
| Compound Name: | N-{3-[5-chloro-4-(3-ethylanilino)-6-oxopyridazin-1(6H)-yl]adamantan-1-yl}acetamide |
| Molecular Weight: | 440.97 |
| Molecular Formula: | C24 H29 Cl N4 O2 |
| Smiles: | CCc1cccc(c1)NC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)(C2)NC(C)=O)C1 |
| Stereo: | ACHIRAL |
| logP: | 4.3238 |
| logD: | 4.3237 |
| logSw: | -4.5103 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.742 |
| InChI Key: | ULDGCDFDYZWMCA-UHFFFAOYSA-N |