N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide
Compound characteristics
| Compound ID: | Y030-8933 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide |
| Molecular Weight: | 335.42 |
| Molecular Formula: | C16 H21 N3 O3 S |
| Smiles: | CCC(C)C(Nc1nnc(Cc2ccc(c(c2)OC)OC)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1616 |
| logD: | 3.1247 |
| logSw: | -3.3607 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.631 |
| InChI Key: | DSAUCEVLDUNYSX-JTQLQIEISA-N |