1-(4-bromophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
1-(4-bromophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrazole-4-carboxamide
1-(4-bromophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | F434-0999 |
| Compound Name: | 1-(4-bromophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 402.31 |
| Molecular Formula: | C18 H16 Br N3 O S |
| Smiles: | CSc1ccc(CNC(c2cnn(c2)c2ccc(cc2)[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3617 |
| logD: | 4.3617 |
| logSw: | -4.1581 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.009 |
| InChI Key: | BHAKAMRIECKLOR-UHFFFAOYSA-N |