N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)dodecanamide
Chemical Structure Depiction of
N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)dodecanamide
N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)dodecanamide
Compound characteristics
| Compound ID: | V019-4725 |
| Compound Name: | N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)dodecanamide |
| Molecular Weight: | 435.65 |
| Molecular Formula: | C22 H33 N3 O2 S2 |
| Smiles: | CCCCCCCCCCCC(Nc1nnc(SCc2cccc(c2)OC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.6638 |
| logD: | 7.6615 |
| logSw: | -5.6601 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.566 |
| InChI Key: | UEOQYAQLEZAYKZ-UHFFFAOYSA-N |