7-ethyl-2-(4-fluorophenyl)-4-(pyridin-4-yl)-1H-1,3,5-benzotriazepine
Chemical Structure Depiction of
7-ethyl-2-(4-fluorophenyl)-4-(pyridin-4-yl)-1H-1,3,5-benzotriazepine
7-ethyl-2-(4-fluorophenyl)-4-(pyridin-4-yl)-1H-1,3,5-benzotriazepine
Compound characteristics
| Compound ID: | D165-0144 |
| Compound Name: | 7-ethyl-2-(4-fluorophenyl)-4-(pyridin-4-yl)-1H-1,3,5-benzotriazepine |
| Molecular Weight: | 344.39 |
| Molecular Formula: | C21 H17 F N4 |
| Smiles: | CCc1ccc2c(c1)N=C(c1ccncc1)N=C(c1ccc(cc1)F)N2 |
| Stereo: | ACHIRAL |
| logP: | 4.2699 |
| logD: | 4.2631 |
| logSw: | -4.1145 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.903 |
| InChI Key: | OHMUOLYNZGSYBR-UHFFFAOYSA-N |