4-amino-N~3~,N~5~-bis[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide
Chemical Structure Depiction of
4-amino-N~3~,N~5~-bis[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide
4-amino-N~3~,N~5~-bis[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide
Compound characteristics
Compound ID: | M050-0975 |
Compound Name: | 4-amino-N~3~,N~5~-bis[(3-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide |
Molecular Weight: | 426.49 |
Molecular Formula: | C21 H22 N4 O4 S |
Smiles: | COc1cccc(CNC(c2c(c(C(NCc3cccc(c3)OC)=O)sn2)N)=O)c1 |
Stereo: | ACHIRAL |
logP: | 2.642 |
logD: | 2.642 |
logSw: | -2.9892 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 94.801 |
InChI Key: | FLYPRTIKGORIAW-UHFFFAOYSA-N |