[5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetonitrile
Chemical Structure Depiction of
[5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetonitrile
[5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetonitrile
Compound characteristics
| Compound ID: | 8018-8623 |
| Compound Name: | [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetonitrile |
| Molecular Weight: | 275.26 |
| Molecular Formula: | C12 H13 N5 O3 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nnn(CC#N)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.7233 |
| logD: | 0.7233 |
| logSw: | -1.1258 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 79.061 |
| InChI Key: | ISLFTEKCHKHIMO-UHFFFAOYSA-N |