N-[3-(4-bromo-1H-pyrazol-1-yl)propyl]-4-iodo-1-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromo-1H-pyrazol-1-yl)propyl]-4-iodo-1-methyl-1H-pyrazole-5-carboxamide
N-[3-(4-bromo-1H-pyrazol-1-yl)propyl]-4-iodo-1-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-9901 |
| Compound Name: | N-[3-(4-bromo-1H-pyrazol-1-yl)propyl]-4-iodo-1-methyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 438.06 |
| Molecular Formula: | C11 H13 Br I N5 O |
| Smiles: | Cn1c(C(NCCCn2cc(cn2)[Br])=O)c(cn1)I |
| Stereo: | ACHIRAL |
| logP: | 1.2256 |
| logD: | 1.2256 |
| logSw: | -1.7216 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.765 |
| InChI Key: | NTPOIUIIAOMLMX-UHFFFAOYSA-N |