4-nitro-N-(2-phenylethyl)-2,1,3-benzoxadiazol-5-amine
Chemical Structure Depiction of
4-nitro-N-(2-phenylethyl)-2,1,3-benzoxadiazol-5-amine
4-nitro-N-(2-phenylethyl)-2,1,3-benzoxadiazol-5-amine
Compound characteristics
| Compound ID: | 4061-0055 |
| Compound Name: | 4-nitro-N-(2-phenylethyl)-2,1,3-benzoxadiazol-5-amine |
| Molecular Weight: | 284.27 |
| Molecular Formula: | C14 H12 N4 O3 |
| Smiles: | C(CNc1ccc2c(c1[N+]([O-])=O)non2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6259 |
| logD: | 3.6259 |
| logSw: | -3.8905 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.486 |
| InChI Key: | PUJHSVBGAYPRED-UHFFFAOYSA-N |