N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide
Compound characteristics
| Compound ID: | Y030-8588 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | CCC(C(Nc1nnc(Cc2ccc(c(c2)OC)OC)s1)=O)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1958 |
| logD: | 4.1543 |
| logSw: | -4.2663 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.031 |
| InChI Key: | ANBQZRBDOARNFG-INIZCTEOSA-N |