4-bromo-2-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 2-chlorobenzoate
Chemical Structure Depiction of
4-bromo-2-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 2-chlorobenzoate
4-bromo-2-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 2-chlorobenzoate
Compound characteristics
| Compound ID: | 8006-2205 |
| Compound Name: | 4-bromo-2-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 2-chlorobenzoate |
| Molecular Weight: | 599.95 |
| Molecular Formula: | C30 H32 Br Cl N2 O4 |
| Smiles: | CC(C)(C)CC(C)(C)c1ccc(cc1)OCC(N/N=C/c1cc(ccc1OC(c1ccccc1[Cl])=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 8.8161 |
| logD: | 8.8115 |
| logSw: | -6.2907 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.304 |
| InChI Key: | DNUOOIXNUGCQFV-UHFFFAOYSA-N |