N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide
N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | C328-0422 |
| Compound Name: | N-[(5-{[2-(4-butylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C20 H22 N4 O4 S |
| Smiles: | CCCCc1ccc(cc1)NC(CSc1nnc(CNC(c2ccco2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2712 |
| logD: | 3.2712 |
| logSw: | -3.5137 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.142 |
| InChI Key: | TWKZOHONBUVNLA-UHFFFAOYSA-N |