N-(4-fluorophenyl)-5-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-fluorophenyl)-5-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0961 |
| Compound Name: | N-(4-fluorophenyl)-5-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C20 H19 F N4 O3 S |
| Smiles: | COc1ccc(CNC(CCc2nnc(C(Nc3ccc(cc3)F)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6288 |
| logD: | 2.6261 |
| logSw: | -3.1692 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.073 |
| InChI Key: | NEWAGXGCEZVPJM-UHFFFAOYSA-N |