N-[2-(4-methylpiperazin-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[2-(4-methylpiperazin-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
N-[2-(4-methylpiperazin-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | E008-0231 |
| Compound Name: | N-[2-(4-methylpiperazin-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C23 H30 N6 O S |
| Smiles: | CN1CCN(CCNC(CSCc2cnn(c3ccccc3)c2n2cccc2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.5551 |
| logD: | 1.8876 |
| logSw: | -2.539 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.596 |
| InChI Key: | RFRDFYPMNWKUOR-UHFFFAOYSA-N |