N'-butyl-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea
Chemical Structure Depiction of
N'-butyl-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea
N'-butyl-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea
Compound characteristics
| Compound ID: | V025-3797 |
| Compound Name: | N'-butyl-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea |
| Molecular Weight: | 456.61 |
| Molecular Formula: | C25 H37 F N6 O |
| Salt: | not_available |
| Smiles: | CCCCNC(N(Cc1c(C)nn(c2cccc(c2)F)c1N1CCN(CC)CC1)C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7747 |
| logD: | 2.706 |
| logSw: | -4.5119 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.222 |
| InChI Key: | LPJRZCJFNNIXHZ-UHFFFAOYSA-N |