N-(3-fluorophenyl)-5-({[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]amino}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-({[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]amino}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-({[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]amino}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L061-0425 |
Compound Name: | N-(3-fluorophenyl)-5-({[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]amino}methyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 453.45 |
Molecular Formula: | C21 H16 F N5 O4 S |
Smiles: | COc1ccc(cc1)c1cc(C(NCc2nnc(C(Nc3cccc(c3)F)=O)s2)=O)no1 |
Stereo: | ACHIRAL |
logP: | 3.6793 |
logD: | 3.676 |
logSw: | -4.0655 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 100.821 |
InChI Key: | XZLOTTUEDRONJB-UHFFFAOYSA-N |