dimethyl 4,4'-(triaz-1-ene-1,3-diyl)dibenzoate
Chemical Structure Depiction of
dimethyl 4,4'-(triaz-1-ene-1,3-diyl)dibenzoate
dimethyl 4,4'-(triaz-1-ene-1,3-diyl)dibenzoate
Compound characteristics
| Compound ID: | 0874-0576 |
| Compound Name: | dimethyl 4,4'-(triaz-1-ene-1,3-diyl)dibenzoate |
| Molecular Weight: | 313.31 |
| Molecular Formula: | C16 H15 N3 O4 |
| Smiles: | COC(c1ccc(cc1)N/N=N/c1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.818 |
| logD: | 3.818 |
| logSw: | -4.2279 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.075 |
| InChI Key: | DFOAQDYVNHMJTD-UHFFFAOYSA-N |