N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide
Chemical Structure Depiction of
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide
Compound characteristics
| Compound ID: | V002-7110 |
| Compound Name: | N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide |
| Molecular Weight: | 363.54 |
| Molecular Formula: | C18 H25 N3 O S2 |
| Smiles: | CCCCC(Nc1nnc(SCc2ccc(cc2)C(C)(C)C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5954 |
| logD: | 5.5931 |
| logSw: | -5.2261 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.022 |
| InChI Key: | MRKFYYDIGNOZAL-UHFFFAOYSA-N |