2-{[{[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]methyl}-6-fluorophenol
Chemical Structure Depiction of
2-{[{[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]methyl}-6-fluorophenol
2-{[{[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]methyl}-6-fluorophenol
Compound characteristics
| Compound ID: | V025-3794 |
| Compound Name: | 2-{[{[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]methyl}-6-fluorophenol |
| Molecular Weight: | 499.6 |
| Molecular Formula: | C27 H35 F2 N5 O2 |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(CCOC)Cc2cccc(c2O)F)c(C)nn1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.1945 |
| logD: | 1.1333 |
| logSw: | -4.1111 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.963 |
| InChI Key: | FMDDQIHWMREDJJ-UHFFFAOYSA-N |