4-(5-nitro-1,3-benzoxazol-2-yl)aniline
Chemical Structure Depiction of
4-(5-nitro-1,3-benzoxazol-2-yl)aniline
4-(5-nitro-1,3-benzoxazol-2-yl)aniline
Compound characteristics
Compound ID: | 3560-1950 |
Compound Name: | 4-(5-nitro-1,3-benzoxazol-2-yl)aniline |
Molecular Weight: | 255.23 |
Molecular Formula: | C13 H9 N3 O3 |
Smiles: | c1cc(ccc1c1nc2cc(ccc2o1)[N+]([O-])=O)N |
Stereo: | ACHIRAL |
logP: | 2.4428 |
logD: | 2.4427 |
logSw: | -2.7817 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.236 |
InChI Key: | PZHBCHHGPFRDTL-UHFFFAOYSA-N |