4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-2-(5-methyl-1,3-benzoxazol-2-yl)phenol
Chemical Structure Depiction of
4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-2-(5-methyl-1,3-benzoxazol-2-yl)phenol
4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-2-(5-methyl-1,3-benzoxazol-2-yl)phenol
Compound characteristics
| Compound ID: | 8004-4443 |
| Compound Name: | 4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-2-(5-methyl-1,3-benzoxazol-2-yl)phenol |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C21 H14 Cl N3 O4 |
| Smiles: | Cc1ccc2c(c1)nc(c1cc(ccc1O)/N=C/c1ccc(c(c1)[N+]([O-])=O)[Cl])o2 |
| Stereo: | ACHIRAL |
| logP: | 5.562 |
| logD: | 5.5606 |
| logSw: | -5.6894 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.805 |
| InChI Key: | PNHDGBUVOQKAMO-UHFFFAOYSA-N |