N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide
Chemical Structure Depiction of
N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide
N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | C328-0295 |
| Compound Name: | N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide |
| Molecular Weight: | 450.87 |
| Molecular Formula: | C19 H16 Cl F N4 O4 S |
| Smiles: | COc1ccc(cc1NC(CSc1nnc(CNC(c2ccccc2F)=O)o1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.679 |
| logD: | 2.6753 |
| logSw: | -3.607 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.497 |
| InChI Key: | HNPSMPURVLUPLX-UHFFFAOYSA-N |