5-(4-{[(4-methoxyphenyl)methyl]amino}-4-oxobutyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[(4-methoxyphenyl)methyl]amino}-4-oxobutyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(4-{[(4-methoxyphenyl)methyl]amino}-4-oxobutyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F501-0825 |
Compound Name: | 5-(4-{[(4-methoxyphenyl)methyl]amino}-4-oxobutyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 424.52 |
Molecular Formula: | C22 H24 N4 O3 S |
Smiles: | Cc1ccccc1NC(c1nnc(CCCC(NCc2ccc(cc2)OC)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.8052 |
logD: | 2.8051 |
logSw: | -3.3493 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.375 |
InChI Key: | JKPOGLHSMDNJSB-UHFFFAOYSA-N |