6-hexyl-7-hydroxy-3-{1-[2-(4-nitrophenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-hexyl-7-hydroxy-3-{1-[2-(4-nitrophenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one
6-hexyl-7-hydroxy-3-{1-[2-(4-nitrophenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | 1080-0315 |
Compound Name: | 6-hexyl-7-hydroxy-3-{1-[2-(4-nitrophenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one |
Molecular Weight: | 423.47 |
Molecular Formula: | C23 H25 N3 O5 |
Smiles: | CCCCCCc1cc2C=C(C(\C)=N/Nc3ccc(cc3)[N+]([O-])=O)C(=O)Oc2cc1O |
Stereo: | ACHIRAL |
logP: | 5.9453 |
logD: | 5.9316 |
logSw: | -5.0658 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.515 |
InChI Key: | QISSZUNXYNUSEQ-UHFFFAOYSA-N |