1-(2,3-dihydro-1H-indol-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | E008-0009 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C24 H22 N4 O S |
| Smiles: | C1CN(C(CSCc2cnn(c3ccccc3)c2n2cccc2)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.0816 |
| logD: | 5.0816 |
| logSw: | -4.9554 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.246 |
| InChI Key: | LCQJNIKVPYGMHO-UHFFFAOYSA-N |