N-{5-[(3,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(1H-indol-3-yl)-2-oxoacetamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(1H-indol-3-yl)-2-oxoacetamide
N-{5-[(3,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(1H-indol-3-yl)-2-oxoacetamide
Compound characteristics
| Compound ID: | E136-1361 |
| Compound Name: | N-{5-[(3,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(1H-indol-3-yl)-2-oxoacetamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | Cc1ccc(cc1C)OCc1nnc(NC(C(c2c[nH]c3ccccc23)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8657 |
| logD: | 3.1743 |
| logSw: | -4.7517 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.207 |
| InChI Key: | LBXHRGWNOLGURQ-UHFFFAOYSA-N |