N-(4-methoxyphenyl)-5-(4-{[(3-methoxyphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-5-(4-{[(3-methoxyphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-methoxyphenyl)-5-(4-{[(3-methoxyphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0092 |
| Compound Name: | N-(4-methoxyphenyl)-5-(4-{[(3-methoxyphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C22 H24 N4 O4 S |
| Smiles: | COc1ccc(cc1)NC(c1nnc(CCCC(NCc2cccc(c2)OC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9094 |
| logD: | 2.9093 |
| logSw: | -3.675 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.616 |
| InChI Key: | QYCJMALYPVIHJH-UHFFFAOYSA-N |