N-(3-fluorophenyl)-5-[({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-[({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-[({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0912 |
| Compound Name: | N-(3-fluorophenyl)-5-[({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C21 H21 F N4 O2 S2 |
| Smiles: | C(Cc1ccccc1)CNC(CSCc1nnc(C(Nc2cccc(c2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1383 |
| logD: | 4.135 |
| logSw: | -4.3352 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.37 |
| InChI Key: | ULVXIDCDYWRKCJ-UHFFFAOYSA-N |