N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide
Chemical Structure Depiction of
N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide
N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide
Compound characteristics
| Compound ID: | V009-4248 |
| Compound Name: | N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenylbutanamide |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C21 H23 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CCC(C(Nc1nnc(SCc2cc(cc(c2)OC)OC)s1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5603 |
| logD: | 5.5432 |
| logSw: | -5.372 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.052 |
| InChI Key: | YQQJHJOSJJEVQI-GOSISDBHSA-N |