N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methoxyacetamide
Chemical Structure Depiction of
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methoxyacetamide
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methoxyacetamide
Compound characteristics
| Compound ID: | V013-9125 |
| Compound Name: | N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methoxyacetamide |
| Molecular Weight: | 351.49 |
| Molecular Formula: | C16 H21 N3 O2 S2 |
| Smiles: | CC(C)(C)c1ccc(CSc2nnc(NC(COC)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2364 |
| logD: | 4.2351 |
| logSw: | -4.2375 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.446 |
| InChI Key: | NUOHRCQLSKYSLX-UHFFFAOYSA-N |