N-ethyl-N'-{1-[(pentafluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Chemical Structure Depiction of
N-ethyl-N'-{1-[(pentafluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
N-ethyl-N'-{1-[(pentafluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Compound characteristics
| Compound ID: | Y500-8850 |
| Compound Name: | N-ethyl-N'-{1-[(pentafluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea |
| Molecular Weight: | 350.31 |
| Molecular Formula: | C13 H11 F5 N4 S |
| Smiles: | CCNC(Nc1ccn(Cc2c(c(c(c(c2F)F)F)F)F)n1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.9141 |
| logD: | 2.9141 |
| logSw: | -3.1901 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.236 |
| InChI Key: | RLZGHBUUOIGBBU-UHFFFAOYSA-N |