2-({3-[(4-ethylphenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Chemical Structure Depiction of
2-({3-[(4-ethylphenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
2-({3-[(4-ethylphenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Compound characteristics
Compound ID: | F396-0613 |
Compound Name: | 2-({3-[(4-ethylphenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-fluorophenyl)acetamide |
Molecular Weight: | 504.6 |
Molecular Formula: | C26 H21 F N4 O2 S2 |
Smiles: | CCc1ccc(CN2C(=Nc3c4cccnc4sc3C2=O)SCC(Nc2cccc(c2)F)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.736 |
logD: | 5.7359 |
logSw: | -5.6746 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.821 |
InChI Key: | NSCRBGQQTDNVPH-UHFFFAOYSA-N |