N-(adamantan-1-yl)-3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamide
N-(adamantan-1-yl)-3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | 6228-1355 |
| Compound Name: | N-(adamantan-1-yl)-3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamide |
| Molecular Weight: | 442.4 |
| Molecular Formula: | C23 H28 Br N3 O |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)C(NC23CC4CC(CC(C4)C3)C2)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4473 |
| logD: | 4.4473 |
| logSw: | -4.4544 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.629 |
| InChI Key: | OTOOVFDIROSTTJ-UHFFFAOYSA-N |