3-butanamido-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3-butanamido-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
3-butanamido-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | Y031-0348 |
| Compound Name: | 3-butanamido-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C16 H20 N4 O3 S2 |
| Smiles: | CCCC(Nc1cccc(c1)C(Nc1nnc(SCCOC)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1358 |
| logD: | 3.049 |
| logSw: | -3.4319 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.727 |
| InChI Key: | IKLSFMUOOGUSHS-UHFFFAOYSA-N |