5-{[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-1215 |
| Compound Name: | 5-{[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 440.59 |
| Molecular Formula: | C22 H24 N4 O2 S2 |
| Smiles: | CCc1ccc(CNC(CSCc2nnc(C(Nc3ccccc3C)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1574 |
| logD: | 4.1573 |
| logSw: | -4.0193 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.831 |
| InChI Key: | TVRQEDNIIFEOED-UHFFFAOYSA-N |