N'-(3-chlorophenyl)-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea
Chemical Structure Depiction of
N'-(3-chlorophenyl)-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea
N'-(3-chlorophenyl)-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea
Compound characteristics
| Compound ID: | V004-4535 |
| Compound Name: | N'-(3-chlorophenyl)-N-cyclopropyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}urea |
| Molecular Weight: | 511.04 |
| Molecular Formula: | C27 H32 Cl F N6 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(C2CC2)C(Nc2cccc(c2)[Cl])=O)c(C)nn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.4702 |
| logD: | 3.4015 |
| logSw: | -5.783 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.787 |
| InChI Key: | AERVAWSLNOEGMQ-UHFFFAOYSA-N |