4-nitro-N-(2-phenylethyl)-2,1,3-benzothiadiazol-5-amine
Chemical Structure Depiction of
4-nitro-N-(2-phenylethyl)-2,1,3-benzothiadiazol-5-amine
4-nitro-N-(2-phenylethyl)-2,1,3-benzothiadiazol-5-amine
Compound characteristics
| Compound ID: | 0599-0781 |
| Compound Name: | 4-nitro-N-(2-phenylethyl)-2,1,3-benzothiadiazol-5-amine |
| Molecular Weight: | 300.34 |
| Molecular Formula: | C14 H12 N4 O2 S |
| Smiles: | C(CNc1ccc2c(c1[N+]([O-])=O)nsn2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6021 |
| logD: | 3.6021 |
| logSw: | -3.8425 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.349 |
| InChI Key: | VAUQZUBCUYCHJM-UHFFFAOYSA-N |