N-(3-ethylphenyl)-2-[(6-oxo-9-phenyl-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-ethylphenyl)-2-[(6-oxo-9-phenyl-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
N-(3-ethylphenyl)-2-[(6-oxo-9-phenyl-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | G754-0148 |
Compound Name: | N-(3-ethylphenyl)-2-[(6-oxo-9-phenyl-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide |
Molecular Weight: | 405.48 |
Molecular Formula: | C21 H19 N5 O2 S |
Smiles: | CCc1cccc(c1)NC(CSc1nc2C(NC=Nc2n1c1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1949 |
logD: | 3.1937 |
logSw: | -3.5069 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.323 |
InChI Key: | UTSKOBKUCPMPLB-UHFFFAOYSA-N |