N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)propanamide
Chemical Structure Depiction of
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)propanamide
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)propanamide
Compound characteristics
| Compound ID: | C798-1120 |
| Compound Name: | N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)propanamide |
| Molecular Weight: | 532.68 |
| Molecular Formula: | C29 H33 F N6 O S |
| Smiles: | C(CSCc1cnn(c2ccccc2)c1n1cccc1)C(NCCN1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.512 |
| logD: | 4.4581 |
| logSw: | -4.1019 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.078 |
| InChI Key: | VSXWOSMYCCHNET-UHFFFAOYSA-N |