2-chloro-3-(3-nitroanilino)naphthalene-1,4-dione
Chemical Structure Depiction of
2-chloro-3-(3-nitroanilino)naphthalene-1,4-dione
2-chloro-3-(3-nitroanilino)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 4204-0024 |
| Compound Name: | 2-chloro-3-(3-nitroanilino)naphthalene-1,4-dione |
| Molecular Weight: | 328.71 |
| Molecular Formula: | C16 H9 Cl N2 O4 |
| Smiles: | c1ccc2C(C(=C(C(c2c1)=O)Nc1cccc(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9129 |
| logD: | 3.455 |
| logSw: | -4.4867 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.945 |
| InChI Key: | BTTSBROSCNLVBK-UHFFFAOYSA-N |