N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutane-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutane-1-sulfonyl)benzamide
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutane-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | Y031-3699 |
| Compound Name: | N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutane-1-sulfonyl)benzamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C16 H21 N3 O4 S2 |
| Smiles: | CC(C)CCS(c1ccccc1C(Nc1nnc(COC)s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7301 |
| logD: | 1.0738 |
| logSw: | -3.687 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.83 |
| InChI Key: | YVEAVGPLUKOHQT-UHFFFAOYSA-N |