2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[3-(pyrrolidin-1-yl)butyl]acetamide
Chemical Structure Depiction of
2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[3-(pyrrolidin-1-yl)butyl]acetamide
2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[3-(pyrrolidin-1-yl)butyl]acetamide
Compound characteristics
| Compound ID: | G819-0256 |
| Compound Name: | 2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[3-(pyrrolidin-1-yl)butyl]acetamide |
| Molecular Weight: | 453.61 |
| Molecular Formula: | C24 H31 N5 O2 S |
| Smiles: | CC(CCNC(CS(Cc1cnn(c2ccccc2)c1n1cccc1)=O)=O)N1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3561 |
| logD: | -1.0966 |
| logSw: | -2.6135 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.187 |
| InChI Key: | ONJZELFTLLDNGC-UHFFFAOYSA-N |