N-[2-(1H-indol-3-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
N-[2-(1H-indol-3-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
Compound ID: | E008-0154 |
Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide |
Molecular Weight: | 455.58 |
Molecular Formula: | C26 H25 N5 O S |
Smiles: | C(CNC(CSCc1cnn(c2ccccc2)c1n1cccc1)=O)c1c[nH]c2ccccc12 |
Stereo: | ACHIRAL |
logP: | 4.8542 |
logD: | 4.8542 |
logSw: | -4.8446 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.007 |
InChI Key: | SQRKSJCQKMVWOZ-UHFFFAOYSA-N |