3-bromo-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
3-bromo-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide
3-bromo-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | V028-7502 |
| Compound Name: | 3-bromo-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(propan-2-yl)benzamide |
| Molecular Weight: | 542.49 |
| Molecular Formula: | C27 H33 Br F N5 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(C(C)C)C(c2cccc(c2)[Br])=O)c(C)nn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.4144 |
| logD: | 3.3457 |
| logSw: | -5.4238 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.406 |
| InChI Key: | IECHRDSWGDLMSH-UHFFFAOYSA-N |