N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide
Chemical Structure Depiction of
N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide
N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | C328-0290 |
| Compound Name: | N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-2-fluorobenzamide |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C22 H23 F N4 O3 S |
| Smiles: | CCCCc1ccc(cc1)NC(CSc1nnc(CNC(c2ccccc2F)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3953 |
| logD: | 4.3953 |
| logSw: | -4.3108 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.564 |
| InChI Key: | YXDUFHIOTVCGLM-UHFFFAOYSA-N |