N-(4-methoxyphenyl)-5-{[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-5-{[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-methoxyphenyl)-5-{[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0039 |
| Compound Name: | N-(4-methoxyphenyl)-5-{[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C21 H22 N4 O4 S2 |
| Smiles: | COc1ccc(CNC(CSCc2nnc(C(Nc3ccc(cc3)OC)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1984 |
| logD: | 3.1983 |
| logSw: | -3.5987 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.616 |
| InChI Key: | UZEARHNQMIJFQI-UHFFFAOYSA-N |