2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | C786-4236 |
| Compound Name: | 2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 394.4 |
| Molecular Formula: | C21 H19 F N4 O3 |
| Smiles: | COc1ccccc1CCNC(CN1C(c2cc3cc(ccc3n2C=N1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1112 |
| logD: | 2.1112 |
| logSw: | -2.9982 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.627 |
| InChI Key: | BIRVJTSQZBESRM-UHFFFAOYSA-N |