3-amino-4-(4-bromoanilino)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-amino-4-(4-bromoanilino)-2H-1-benzopyran-2-one
3-amino-4-(4-bromoanilino)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1069-0035 |
| Compound Name: | 3-amino-4-(4-bromoanilino)-2H-1-benzopyran-2-one |
| Molecular Weight: | 331.17 |
| Molecular Formula: | C15 H11 Br N2 O2 |
| Smiles: | c1ccc2c(c1)C(=C(C(=O)O2)N)Nc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.1991 |
| logD: | 3.1991 |
| logSw: | -3.8393 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 51.378 |
| InChI Key: | YSOAHTPGHQZMCN-UHFFFAOYSA-N |