(adamantan-1-yl)[3-methyl-5-phenyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
(adamantan-1-yl)[3-methyl-5-phenyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone
(adamantan-1-yl)[3-methyl-5-phenyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone
Compound characteristics
| Compound ID: | 3339-1378 |
| Compound Name: | (adamantan-1-yl)[3-methyl-5-phenyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone |
| Molecular Weight: | 428.6 |
| Molecular Formula: | C27 H28 N2 O S |
| Smiles: | Cc1c(c(c2ccccc2)n(C(C23CC4CC(CC(C4)C3)C2)=O)n1)Sc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4702 |
| logD: | 6.4702 |
| logSw: | -5.8663 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.3719 |
| InChI Key: | DMKMQKUBMWKECU-UHFFFAOYSA-N |