2-(adamantan-1-yl)-4-chloro-5-{[5-(naphthalen-1-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-{[5-(naphthalen-1-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-{[5-(naphthalen-1-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | 8016-6423 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-{[5-(naphthalen-1-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}pyridazin-3(2H)-one |
| Molecular Weight: | 566.12 |
| Molecular Formula: | C32 H28 Cl N5 O S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1C(C(=C(C=N1)Sc1nnc(c2cccc3ccccc23)n1c1ccccc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.785 |
| logD: | 7.785 |
| logSw: | -6.8987 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.977 |
| InChI Key: | OSODHTKSYUNROU-UHFFFAOYSA-N |