N-{1-[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{1-[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}-4-methylbenzene-1-sulfonamide
N-{1-[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G944-0161 |
| Compound Name: | N-{1-[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C21 H24 N6 O3 S |
| Smiles: | CCn1c2ccc(cc2nn1)c1nc(C(C(C)C)NS(c2ccc(C)cc2)(=O)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5265 |
| logD: | 4.4467 |
| logSw: | -4.1879 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.662 |
| InChI Key: | SZWICAMKQSCFSW-IBGZPJMESA-N |