2-nitro-4-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl furan-2-carboxylate
Chemical Structure Depiction of
2-nitro-4-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl furan-2-carboxylate
2-nitro-4-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl furan-2-carboxylate
Compound characteristics
| Compound ID: | 8003-1627 |
| Compound Name: | 2-nitro-4-[(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl furan-2-carboxylate |
| Molecular Weight: | 521.57 |
| Molecular Formula: | C28 H31 N3 O7 |
| Smiles: | CC(C)(C)CC(C)(C)c1ccc(cc1)OCC(N/N=C/c1ccc(c(c1)[N+]([O-])=O)OC(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.961 |
| logD: | 5.9606 |
| logSw: | -5.5453 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.963 |
| InChI Key: | VUZCJNKPAUZZLL-UHFFFAOYSA-N |