N'-butyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea
Chemical Structure Depiction of
N'-butyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea
N'-butyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea
Compound characteristics
| Compound ID: | V014-2382 |
| Compound Name: | N'-butyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea |
| Molecular Weight: | 474.62 |
| Molecular Formula: | C25 H39 F N6 O2 |
| Salt: | not_available |
| Smiles: | CCCCNC(N(CCOC)Cc1c(C)nn(c2cccc(c2)F)c1N1CCN(CC)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8416 |
| logD: | 1.7729 |
| logSw: | -3.872 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.239 |
| InChI Key: | PQMMZPOJOSWBDZ-UHFFFAOYSA-N |