N-(3-fluorophenyl)-5-[({2-oxo-2-[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-[({2-oxo-2-[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-[({2-oxo-2-[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-1029 |
| Compound Name: | N-(3-fluorophenyl)-5-[({2-oxo-2-[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C22 H23 F N4 O3 S2 |
| Smiles: | CC(C)Oc1ccc(CNC(CSCc2nnc(C(Nc3cccc(c3)F)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0536 |
| logD: | 4.0503 |
| logSw: | -4.0628 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.331 |
| InChI Key: | ZQTIYYXXRHQSGY-UHFFFAOYSA-N |