6-bromo-3-{1-[2-(3,4-dimethylphenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-{1-[2-(3,4-dimethylphenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one
6-bromo-3-{1-[2-(3,4-dimethylphenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K007-0287 |
| Compound Name: | 6-bromo-3-{1-[2-(3,4-dimethylphenyl)hydrazinylidene]ethyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 385.26 |
| Molecular Formula: | C19 H17 Br N2 O2 |
| Smiles: | C/C(C1=Cc2cc(ccc2OC1=O)[Br])=N/Nc1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5553 |
| logD: | 5.5552 |
| logSw: | -5.5274 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.585 |
| InChI Key: | IRFOIHZVCUVKOV-UHFFFAOYSA-N |