4-(2-aminoanilino)-3-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-(2-aminoanilino)-3-nitro-2H-1-benzopyran-2-one
4-(2-aminoanilino)-3-nitro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 3027-0072 |
| Compound Name: | 4-(2-aminoanilino)-3-nitro-2H-1-benzopyran-2-one |
| Molecular Weight: | 297.27 |
| Molecular Formula: | C15 H11 N3 O4 |
| Smiles: | c1ccc2c(c1)C(=C(C(=O)O2)[N+]([O-])=O)Nc1ccccc1N |
| Stereo: | ACHIRAL |
| logP: | 2.1393 |
| logD: | -1.6179 |
| logSw: | -3.0182 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.969 |
| InChI Key: | FWHRQRLEMZBNQG-UHFFFAOYSA-N |