N~3~,N~4~-bis[(1H-benzotriazol-1-yl)methyl]-1,2,5-oxadiazole-3,4-diamine
Chemical Structure Depiction of
N~3~,N~4~-bis[(1H-benzotriazol-1-yl)methyl]-1,2,5-oxadiazole-3,4-diamine
N~3~,N~4~-bis[(1H-benzotriazol-1-yl)methyl]-1,2,5-oxadiazole-3,4-diamine
Compound characteristics
| Compound ID: | 8010-6952 |
| Compound Name: | N~3~,N~4~-bis[(1H-benzotriazol-1-yl)methyl]-1,2,5-oxadiazole-3,4-diamine |
| Molecular Weight: | 362.35 |
| Molecular Formula: | C16 H14 N10 O |
| Smiles: | C(Nc1c(NCn2c3ccccc3nn2)non1)n1c2ccccc2nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.1285 |
| logD: | 2.1285 |
| logSw: | -2.2032 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.307 |
| InChI Key: | APTPWVCMUKHGJC-UHFFFAOYSA-N |