2-({4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-({4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide
2-({4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide
Compound characteristics
Compound ID: | E196-0404 |
Compound Name: | 2-({4-oxo-3-[(thiophen-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide |
Molecular Weight: | 437.54 |
Molecular Formula: | C21 H19 N5 O2 S2 |
Smiles: | C(CNC(CSC1=Nc2c(C(N1Cc1cccs1)=O)nccn2)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 2.1798 |
logD: | 2.1798 |
logSw: | -2.5675 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.635 |
InChI Key: | KAXCHLAOBYVWBT-UHFFFAOYSA-N |