7-chloro-4-(4-ethoxyphenyl)-2-phenyl-1H-1,3,5-benzotriazepine
Chemical Structure Depiction of
7-chloro-4-(4-ethoxyphenyl)-2-phenyl-1H-1,3,5-benzotriazepine
7-chloro-4-(4-ethoxyphenyl)-2-phenyl-1H-1,3,5-benzotriazepine
Compound characteristics
| Compound ID: | D165-0079 |
| Compound Name: | 7-chloro-4-(4-ethoxyphenyl)-2-phenyl-1H-1,3,5-benzotriazepine |
| Molecular Weight: | 375.86 |
| Molecular Formula: | C22 H18 Cl N3 O |
| Smiles: | CCOc1ccc(cc1)C1N=C(c2ccccc2)Nc2ccc(cc2N=1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4045 |
| logD: | 5.4037 |
| logSw: | -5.9426 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.599 |
| InChI Key: | ZJUALYPZIUOUGH-UHFFFAOYSA-N |