N-[(4-butoxyphenyl)methyl]-4-[(2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(4-butoxyphenyl)methyl]-4-[(2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]benzamide
N-[(4-butoxyphenyl)methyl]-4-[(2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]benzamide
Compound characteristics
Compound ID: | E772-0288 |
Compound Name: | N-[(4-butoxyphenyl)methyl]-4-[(2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]benzamide |
Molecular Weight: | 461.58 |
Molecular Formula: | C26 H27 N3 O3 S |
Smiles: | CCCCOc1ccc(CNC(c2ccc(CN3C(CSc4c3cccn4)=O)cc2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.4303 |
logD: | 4.4303 |
logSw: | -4.0997 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.502 |
InChI Key: | LHRWFORYOHWFPH-UHFFFAOYSA-N |