5-[(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-1372 |
| Compound Name: | 5-[(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 493.4 |
| Molecular Formula: | C19 H17 Br N4 O3 S2 |
| Smiles: | COc1ccc(cc1CNC(CSc1nnc(C(Nc2ccccc2)=O)s1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.856 |
| logD: | 3.856 |
| logSw: | -3.9821 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.025 |
| InChI Key: | XQMKKQAQIALOIZ-UHFFFAOYSA-N |