4-bromo-1-methyl-N-(6-methylheptan-2-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-bromo-1-methyl-N-(6-methylheptan-2-yl)-1H-pyrazole-5-carboxamide
4-bromo-1-methyl-N-(6-methylheptan-2-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-8693 |
| Compound Name: | 4-bromo-1-methyl-N-(6-methylheptan-2-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 316.24 |
| Molecular Formula: | C13 H22 Br N3 O |
| Smiles: | CC(C)CCCC(C)NC(c1c(cnn1C)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7729 |
| logD: | 2.7729 |
| logSw: | -2.9857 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.881 |
| InChI Key: | VVBBZKWZWBTCNX-JTQLQIEISA-N |