N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y030-9465 |
| Compound Name: | N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 307.33 |
| Molecular Formula: | C13 H13 N3 O4 S |
| Smiles: | CCOCc1nnc(NC(c2ccc3c(c2)OCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.1717 |
| logD: | 1.974 |
| logSw: | -2.946 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.544 |
| InChI Key: | MOSAIVDYLXZAID-UHFFFAOYSA-N |