7-ethyl-2-(4-fluorophenyl)-4-(4-methylphenyl)-1H-1,3,5-benzotriazepine
Chemical Structure Depiction of
7-ethyl-2-(4-fluorophenyl)-4-(4-methylphenyl)-1H-1,3,5-benzotriazepine
7-ethyl-2-(4-fluorophenyl)-4-(4-methylphenyl)-1H-1,3,5-benzotriazepine
Compound characteristics
| Compound ID: | D165-0131 |
| Compound Name: | 7-ethyl-2-(4-fluorophenyl)-4-(4-methylphenyl)-1H-1,3,5-benzotriazepine |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C23 H20 F N3 |
| Smiles: | CCc1ccc2c(c1)N=C(c1ccc(C)cc1)N=C(c1ccc(cc1)F)N2 |
| Stereo: | ACHIRAL |
| logP: | 5.9423 |
| logD: | 5.9266 |
| logSw: | -5.6575 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4751 |
| InChI Key: | SAPKOMKEJCQRLV-UHFFFAOYSA-N |