1-(adamantan-1-yl)-4-(4-chlorophenyl)-2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1H-imidazole
Chemical Structure Depiction of
1-(adamantan-1-yl)-4-(4-chlorophenyl)-2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1H-imidazole
1-(adamantan-1-yl)-4-(4-chlorophenyl)-2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1H-imidazole
Compound characteristics
| Compound ID: | 8018-7158 |
| Compound Name: | 1-(adamantan-1-yl)-4-(4-chlorophenyl)-2-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1H-imidazole |
| Molecular Weight: | 510.05 |
| Molecular Formula: | C27 H28 Cl N3 O3 S |
| Smiles: | COc1ccc(CSc2nc(cn2C23CC4CC(CC(C4)C3)C2)c2ccc(cc2)[Cl])cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 7.5694 |
| logD: | 7.5637 |
| logSw: | -6.6935 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.11 |
| InChI Key: | FLYDQTSOEPIKPS-UHFFFAOYSA-N |