(azepan-1-yl)(4-iodo-1-methyl-1H-pyrazol-5-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(4-iodo-1-methyl-1H-pyrazol-5-yl)methanone
(azepan-1-yl)(4-iodo-1-methyl-1H-pyrazol-5-yl)methanone
Compound characteristics
| Compound ID: | Y508-3833 |
| Compound Name: | (azepan-1-yl)(4-iodo-1-methyl-1H-pyrazol-5-yl)methanone |
| Molecular Weight: | 333.17 |
| Molecular Formula: | C11 H16 I N3 O |
| Smiles: | Cn1c(C(N2CCCCCC2)=O)c(cn1)I |
| Stereo: | ACHIRAL |
| logP: | 2.0229 |
| logD: | 2.0229 |
| logSw: | -1.961 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.7335 |
| InChI Key: | TXGCFDZRNGUDRD-UHFFFAOYSA-N |