2,4-dibromo-6-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 3-methylbenzoate
Chemical Structure Depiction of
2,4-dibromo-6-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 3-methylbenzoate
2,4-dibromo-6-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 3-methylbenzoate
Compound characteristics
| Compound ID: | 8002-6248 |
| Compound Name: | 2,4-dibromo-6-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 3-methylbenzoate |
| Molecular Weight: | 658.43 |
| Molecular Formula: | C31 H34 Br2 N2 O4 |
| Smiles: | Cc1cccc(c1)C(=O)Oc1c(/C=N/NC(COc2ccc(cc2)C(C)(C)CC(C)(C)C)=O)cc(cc1[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 9.3251 |
| logD: | 9.2872 |
| logSw: | -5.7226 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.391 |
| InChI Key: | UEBRLSXBHKTQLK-UHFFFAOYSA-N |