5-(5-{4-[(benzenesulfonyl)methyl]phenyl}-1,2,4-oxadiazol-3-yl)-1-propyl-1H-benzotriazole
Chemical Structure Depiction of
5-(5-{4-[(benzenesulfonyl)methyl]phenyl}-1,2,4-oxadiazol-3-yl)-1-propyl-1H-benzotriazole
5-(5-{4-[(benzenesulfonyl)methyl]phenyl}-1,2,4-oxadiazol-3-yl)-1-propyl-1H-benzotriazole
Compound characteristics
| Compound ID: | G944-0327 |
| Compound Name: | 5-(5-{4-[(benzenesulfonyl)methyl]phenyl}-1,2,4-oxadiazol-3-yl)-1-propyl-1H-benzotriazole |
| Molecular Weight: | 459.53 |
| Molecular Formula: | C24 H21 N5 O3 S |
| Smiles: | CCCn1c2ccc(cc2nn1)c1nc(c2ccc(CS(c3ccccc3)(=O)=O)cc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.2736 |
| logD: | 4.2736 |
| logSw: | -4.2319 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 86.085 |
| InChI Key: | IHZVUEJJOOTUJR-UHFFFAOYSA-N |