2-[(2-{[(2H-1,3-benzodioxole-5-carbonyl)amino]acetyl}hydrazinylidene)methyl]-4,6-dibromophenyl 3-bromobenzoate
Chemical Structure Depiction of
2-[(2-{[(2H-1,3-benzodioxole-5-carbonyl)amino]acetyl}hydrazinylidene)methyl]-4,6-dibromophenyl 3-bromobenzoate
2-[(2-{[(2H-1,3-benzodioxole-5-carbonyl)amino]acetyl}hydrazinylidene)methyl]-4,6-dibromophenyl 3-bromobenzoate
Compound characteristics
| Compound ID: | 8006-1939 |
| Compound Name: | 2-[(2-{[(2H-1,3-benzodioxole-5-carbonyl)amino]acetyl}hydrazinylidene)methyl]-4,6-dibromophenyl 3-bromobenzoate |
| Molecular Weight: | 682.12 |
| Molecular Formula: | C24 H16 Br3 N3 O6 |
| Smiles: | C(C(N/N=C/c1cc(cc(c1OC(c1cccc(c1)[Br])=O)[Br])[Br])=O)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2122 |
| logD: | 6.1959 |
| logSw: | -6.1822 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.692 |
| InChI Key: | JWFNLEQRUACUGI-UHFFFAOYSA-N |