N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide
Chemical Structure Depiction of
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide
Compound characteristics
| Compound ID: | V003-3171 |
| Compound Name: | N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide |
| Molecular Weight: | 425.61 |
| Molecular Formula: | C23 H27 N3 O S2 |
| Salt: | not_available |
| Smiles: | CCC(C(Nc1nnc(SCc2ccc(cc2)C(C)(C)C)s1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9524 |
| logD: | 6.9353 |
| logSw: | -5.7669 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | FGBHNSKCIWGDOZ-LJQANCHMSA-N |