2-benzyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
Chemical Structure Depiction of
2-benzyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
2-benzyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | 8370-0237 |
| Compound Name: | 2-benzyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole |
| Molecular Weight: | 327.36 |
| Molecular Formula: | C16 H13 N3 O3 S |
| Smiles: | C(c1ccccc1)c1nnc(o1)SCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2481 |
| logD: | 3.2481 |
| logSw: | -3.4841 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.111 |
| InChI Key: | KYRAWAIIXYRHCZ-UHFFFAOYSA-N |