N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(4-methylphenyl)-N-(propan-2-yl)urea
Chemical Structure Depiction of
N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(4-methylphenyl)-N-(propan-2-yl)urea
N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(4-methylphenyl)-N-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V019-8489 |
| Compound Name: | N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N'-(4-methylphenyl)-N-(propan-2-yl)urea |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C28 H37 F N6 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(C(C)C)C(Nc2ccc(C)cc2)=O)c(C)nn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.2761 |
| logD: | 3.2074 |
| logSw: | -5.136 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.227 |
| InChI Key: | DAKGLPONGBCQMY-UHFFFAOYSA-N |