3-(2-chlorophenyl)-N-{[3-(3,4-dimethylphenyl)adamantan-1-yl]methyl}-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-N-{[3-(3,4-dimethylphenyl)adamantan-1-yl]methyl}-5-methyl-1,2-oxazole-4-carboxamide
3-(2-chlorophenyl)-N-{[3-(3,4-dimethylphenyl)adamantan-1-yl]methyl}-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | K213-0301 |
| Compound Name: | 3-(2-chlorophenyl)-N-{[3-(3,4-dimethylphenyl)adamantan-1-yl]methyl}-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 489.06 |
| Molecular Formula: | C30 H33 Cl N2 O2 |
| Smiles: | Cc1ccc(cc1C)C12CC3CC(CC(C3)(C2)CNC(c2c(c3ccccc3[Cl])noc2C)=O)C1 |
| Stereo: | ACHIRAL |
| logP: | 7.7266 |
| logD: | 7.7266 |
| logSw: | -6.4386 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.374 |
| InChI Key: | IVFQTTRNUSESKI-UHFFFAOYSA-N |