N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
Compound ID: | Y042-3676 |
Compound Name: | N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(3-methylbutyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide |
Molecular Weight: | 388.44 |
Molecular Formula: | C18 H20 N4 O4 S |
Smiles: | CC(C)CCN1C(c2ccc(cc2C1=O)C(Nc1nnc(COC)s1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8124 |
logD: | 1.0782 |
logSw: | -3.4978 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.297 |
InChI Key: | QDLQOWLHEKPIRJ-UHFFFAOYSA-N |